Chembox |
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{{Chembox
| Chembox_ref =
<!-- Names -->
| Name =
| pronounce =
| IUPACName =
| IUPACNames = <!-- -s for plural -->
| PIN =
| SystematicName =
| OtherNames =
<!-- Image parameters: see below -->
<!-- Sections -->
| Section1 =
| Section2 =
| Section3 =
| Section4 =
| Section5 =
| Section6 =
| Section7 =
| Section8 =
| Section9 =
<!-- Style settings -->
| style =
| width =
<!-- Bot parameter. Do not add, change or remove -->
| Verifiedfields =
| Watchedfields =
| verifiedrevid =
<!-- IMAGE row 1/7 -->
| ImageFile =
| ImageSize =
| ImageAlt =
| ImageCaption =
| ImageName =
<!-- IMAGE row 2/7 -->
| ImageFile1 =
| ImageSize1 =
| ImageAlt1 =
| ImageCaption1 =
| ImageName1 =
<!-- IMAGE (L1, R1) row 3/7 -->
| ImageFileL1 =
| ImageSizeL1 =
| ImageAltL1 =
| ImageCaptionL1 =
| ImageNameL1 =
| ImageFileR1 =
| ImageSizeR1 =
| ImageAltR1 =
| ImageCaptionR1 =
| ImageNameR1 =
| ImageCaptionLR1 =
<!-- IMAGE row 4/7 -->
| ImageFile2 =
| ImageSize2 =
| ImageAlt2 =
| ImageCaption2 =
| ImageName2 =
<!-- IMAGE (L2, R2) row 5/7 -->
| ImageFileL2 =
| ImageSizeL2 =
| ImageAltL2 =
| ImageCaptionL2 =
| ImageNameL2 =
| ImageFileR2 =
| ImageSizeR2 =
| ImageAltR2 =
| ImageCaptionR2 =
| ImageNameR2 =
| ImageCaptionLR2=
<!-- IMAGE row 6/7 -->
| ImageFile3 =
| ImageSize3 =
| ImageAlt3 =
| ImageCaption3 =
| ImageName3 =
<!-- IMAGE (L3, 3R) row 7/7 -->
| ImageFileL3 =
| ImageSizeL3 =
| ImageAltL3 =
| ImageCaptionL3 =
| ImageNameL3 =
| ImageFileR3 =
| ImageSizeR3 =
| ImageAltR3 =
| ImageCaptionR3 =
| ImageNameR3 =
| ImageCaptionLR3=
<!-- -->
| ImageCaptionAll =
<!-- non-default (data page) pagename (link in Supplement) -->
| data page pagename =
<!-- footer settings -->
| container_only =
| show_footer =
| show_ss_note =
| show_infobox_ref =
| general_note =
}}
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|Section1={{Chembox Identifiers
| Identifiers_ref =
<!--index labeling-->
| index_label =
| index1_label =
| indexlist_caption =
| index_comment =
| index1_comment =
<!--CASNo, +ix 1–5-->
| CASNo =
| CASNo_Comment =
| CASNo1 =
| CASNo1_Comment =
| CASNoOther =
<!--ChEBI, +ix 1–5-->
| ChEBI =
| ChEBI_Comment =
| ChEBI1 =
| ChEBI1_Comment =
| ChEBIOther =
<!--ChEMBL, +ix 1–5-->
| ChEMBL =
| ChEMBL_Comment =
| ChEMBL1 =
| ChEMBL1_Comment =
| ChEMBLOther =
<!--ChemSpiderID, +ix 1–5-->
| ChemSpiderID =
| ChemSpiderID_Comment =
| ChemSpiderID1 =
| ChemSpiderID1_Comment =
| ChemSpiderIDOther =
<!--DrugBank, +ix 1–5-->
| DrugBank =
| DrugBank_Comment =
| DrugBank1 =
| DrugBank1_Comment =
| DrugBankOther =
<!--IUPHAR_ligand, +ix 1–5-->
| IUPHAR_ligand =
| IUPHAR_ligand_Comment =
| IUPHAR_ligand1 =
| IUPHAR_ligand1_Comment =
| IUPHAR_ligand_Other =
<!--KEGG, +ix 1–5-->
| KEGG =
| KEGG_Comment =
| KEGG1 =
| KEGG1_Comment =
| KEGGOther =
<!--PubChem, +ix 1–5-->
| PubChem =
| PubChem_Comment =
| PubChem1 =
| PubChem1_Comment =
| PubChemOther =
<!--SMILES, Jmol 1–5-->
| SMILES =
| SMILES_Comment =
| SMILES1 =
| SMILES1_Comment =
| SMILESOther =
| Jmol =
| Jmol1 =
<!--StdInChI-->
| StdInChI =
| StdInChI_Comment =
| StdInChIKey =
<!--InChI, InChIKey: index 1–5-->
| InChI =
| InChI_Comment =
| InChIKey =
| InChI1 =
| InChI1_Comment =
| InChIKey1 =
| InChIOther =
<!--UNII, +ix 1–5-->
| UNII =
| UNII_Comment =
| UNII1 =
| UNII1_Comment =
| UNIIOther =
<!--DTXSID (CompTox), +ix 1–5-->
| DTXSID =
| DTXSID1 ... DTXSID5 =
| DTXSIDOther =
<!--3DMet, +ix 1–5-->
| 3DMet =
<!--EC_number, +ix 1–5-->
| EC_number =
| EC_number1 ... EC_number5 =
| EC_number_Comment =
| EINECS =
<!--RTECS, +ix 1–5-->
| RTECS =
| RTECS1 ... RTECS5 =
| RTECSOther =
<!--non-index parameters-->
| Abbreviations =
| Beilstein =
| Gmelin =
| MeSHName =
| UNNumber =
}}
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{{Chembox Identifiers}}
------
CAS registry number, links to http://www.commonchemistry.org/
CAS registry number comment
Other CAS RN (unformatted)
------
ChEBI, links to http://www.ebi.ac.uk/chebi/
------
ChEMBL
------
ChemSpider ID, links to http://www.chemspider.com/
ChemSpider ID comment
Other ChemSpider ID
------
DrugBank
comment
Other DrugBank
------
IUPHAR/BPS
comment
Other IUPHAR
------
KEGG entry, links to http://www.genome.jp/kegg/
------
PubChem compound ID, links to https://pubchem.ncbi.nlm.nih.gov/
PubChem compound ID comment
Other PubChem compound ID
------
SMILES
SMILES comment
Other SMILES
------
StdInChI
StdInChI comment
StdInChI Key
------
InChI
InChI comment
InChI Key
Other InChI
------
UNII: Unique Ingredient Identifier, by FDA
UNII comment
Other UNII
------
DTXSID: CompTox Chemistry Dashboard (default: Property P3117 from Wikidata)
------
Abbreviations
Beilstein reference
Gmelin ID
MeSH heading, links to https://www.nlm.nih.gov/mesh/
UN number
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| Section2={{Chembox Properties
| Properties_ref =
| Formula =
| Formula_ref =
| Formula_Comment =
| C= | H= | N= <!--(etc)-->
| Formula_Charge =
| MolarMass =
| MolarMassRound =
| MolarMass_ref =
| MolarMass_notes =
| Appearance =
| Odor = | Odour =
| Density =
| MeltingPt =
| MeltingPtC =
| MeltingPtF =
| MeltingPtK =
| MeltingPt_ref =
| MeltingPt_notes =
| BoilingPt =
| BoilingPtC =
| BoilingPtF =
| BoilingPtK =
| BoilingPt_ref =
| BoilingPt_notes =
| CriticalTP =
| SublimationConditions =
| Solubility =
| SolubilityProduct =
| SolubilityProductAs =
| SolubleOther =
| Solvent =
| Solubility1 =
| Solvent1 =
| Solubility2 =
| Solvent2 =
| Solubility3 =
| Solvent3 =
| Solubility4 =
| Solvent4 =
| Solubility5 =
| Solvent5 =
| Solubility6 =
| Solvent6 =
| CMC =
| HLB =
| LogP =
| VaporPressure =
| HenryConstant =
| AtmosphericOHRateConstant =
| pKa =
| pKb =
| ConjugateAcid =
| ConjugateBase =
| IsoelectricPt =
| ElectricalResistivity =
| LambdaMax =
| Absorbance =
| BandGap =
| ElectronMobility =
| SpecRotation =
| MagSus =
| ThermalConductivity =
| RefractIndex =
| Viscosity =
| CriticalRelativeHumidity =
| Dipole =
| OrbitalHybridisation =
| SpecificSurfaceArea =
| PoreVolume =
| AveragePoreSize =
}}
|
{{Chembox Properties}} - incomplete list
Reference
Chemical formula
reference
comment
per element (alternative input)
molecule charge
MolarMass
MolarMassRound
MolarMass_ref
MolarMass_notes
Appearance
Odor, Odour
Density
MeltingPt, any text
Number, in Celsius. Is converted to F and K
Also possible: MeltingPtF=, or MeltingPtK=
BoilingPt, any text
Number, in Celsius. Is converted to F and K
Also possible: BoilingPtF=, or BoilingPtK=
Critical temperature and pressure
SublimationConditions
Solubility in water (Aqueous solution)
SolubilityProduct
SolubilityProductAs
SolubleOther
Solvent
Solubility1
[[{{{Solvent1}}}]]
Solubility2
[[{{{Solvent2}}}]]
Solubility3
[[{{{Solvent3}}}]]
Solubility4
[[{{{Solvent4}}}]]
Solubility5
[[{{{Solvent5}}}]]
Solubility6
[[{{{Solvent6}}}]]
CMC
HLB
LogP
VaporPressure
HenryConstant
AtmosphericOHRateConstant
pKa
pKb
Conjugate acid
Conjugate base
IsoelectricPt
ElectricalResistivity
LambdaMax
Absorbance
BandGap
ElectronMobility
SpecRotation
MagSus
ThermalConductivity
RefractIndex
Viscosity
CriticalRelativeHumidity
Dipole
OrbitalHybridisation
SpecificSurfaceArea
PoreVolume
AveragePoreSize
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Complete list
| Section3 = {{Chembox Structure
| Structure_ref =
| CrystalStruct =
| SpaceGroup =
| PointGroup =
| LattConst_a =
| LattConst_b =
| LattConst_c =
| LattConst_alpha =
| LattConst_beta =
| LattConst_gamma =
| LattConst_ref =
| LattConst_Comment =
| UnitCellVolume =
| UnitCellFormulas =
| Coordination =
| MolShape =
| OrbitalHybridisation =
| Dipole =
}}
|
{{Chembox Structure}}
Reference in header
Crystal structure
Space group (free text)
Molecular symmetry "Point group"
Lattice constant (a, b, c)
α, β, γ angles (don't add the ° sign)
Reference for the lattice values
Comment for lattice (any text)
Lattice volume
Number of formulas
Coordination geometry
Molecular geometry
Orbital hybridisation
Dipole moment
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Complete list
Note: Add units like
kJ·mol<sup>−1</sup>
J·mol<sup>−1</sup>·K<sup>−1</sup>
--> |
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| Section6 = {{Chembox Pharmacology
| Pharmacology_ref =
| ATCCode_prefix =
| ATCCode_suffix =
| ATC_Supplemental =
| ATCvet =
| Drug_class =
| Licence_EU =
| INN =
| INN_EMA =
| Licence_US =
| Legal_status =
| Legal_AU =
| Legal_AU_comment =
| Legal_CA =
| Legal_CA_comment =
| Legal_NZ =
| Legal_NZ_comment =
| Legal_UK =
| Legal_UK_comment =
| Legal_US =
| Legal_US_comment =
| Legal_EU =
| Legal_EU_comment =
| Legal_UN =
| Legal_UN_comment =
| Pregnancy_category =
| Pregnancy_AU =
| Pregnancy_AU_comment =
| Dependence_liability =
| Addiction_liability =
| AdminRoutes =
| Bioavail =
| ProteinBound =
| Metabolism =
| Metabolites =
| OnsetOfAction =
| HalfLife =
| DurationOfAction =
| Excretion =
}}
|
{{Chembox Pharmacology}}
Ordered as shown by template
Pharmacokinetics
|
- Complete list
|
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| Section7 = {{Chembox Hazards
| Hazards_ref =
| GHS_ref =
| GHSPictograms =
| GHSSignalWord =
| HPhrases =
| PPhrases =
| OHS_ref =
| MainHazards =
| IngestionHazard =
| InhalationHazard =
| EyeHazard =
| SkinHazard =
| NFPA-H =
| NFPA-F =
| NFPA-I =
| NFPA-S =
| NFPA_ref =
| FlashPt =
| FlashPtC =
| FlashPt_notes =
| FlashPt_ref =
| AutoignitionPt =
| AutoignitionPtC =
| AutoignitionPt_ref=
| AutoignitionPt_notes=
| ExploLimits =
| TLV =
| TLV-TWA =
| TLV-STEL =
| TLV-C =
| LD50 =
| LDLo =
| LC50 =
| LCLo =
| PEL =
| REL =
| IDLH =
| NIOSH_id =
| NIOSH_ref =
<!-- (data page) -->
| ExternalSDS =
}}
|
{{Chembox Hazards}} - complete list
GHS reference (e.g. Template:Sigma-Aldrich)
GHS pictograms. Use GHS templates, e.g., ={{GHS01}}{{GHS07}}
GHS signal word ("Danger", "Warning")
GHS hazard statements. Use {{H-phrases}}
GHS precautionary statements. Use {{P-phrases}}
{{NFPA 704 diamond}}:
Health (blue) hazard code (0–4 or -)
Flammability (red) hazard code (0–4 or -)
Instability–reactivity (yellow) hazard code (0–4 or -). Alias: NFPA-R=
Special hazards (white). See {{NFPA 704 diamond}}
Reference for the NFPA fire diamond
Flash point, any text
Temperature, number in C. Can be a range: '50 to 60'. Also _PtF, _PtK. (see: temperatures)
Autoignition point, any text
Temperature, number in C. Can be a range: '50 to 60'. Also _PtF, _PtK. (see: temperatures)
Threshold limit value
Threshold limit value: time-weighted average
Threshold limit value: short-term exposure limit
Threshold limit value: ceiling limit
Lethal dose, 50% (median lethal dose). Specify species and method (oral/dermal/intravenous), e.g., 950mg/kg (rat, oral)
Lowest lethal dose
Lethal concentration, 50% (median lethal concentration)
Lowest lethal concentration
Permissible exposure limit
Recommended exposure limit
Immediately dangerous to life or health value
Link to an external safety data sheet
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All Related input creates a 'see also' list. It is good practice to use article links.
| Section8 = {{Chembox Related
| Related_ref =
| OtherAnions =
| OtherCations =
| OtherFunction =
| OtherFunction_label =
| OtherCompounds =
}}
|
{{Chembox Related}} - complete list
Ions
Ions
Label text: "Related {{{OtherFunction_label}}}"
Other compounds
|
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| Section = {{Chembox Supplement
| data page pagename =
}}
|
{{Chembox Supplement}} - complete list
Set data page name, default is: <PAGENAME> (data page)
|
<nowiki>{{</nowiki>Chembox
| show_ss_note =
| general_note =
| show_infobox_ref =
<!-- bot maintained fields, do not edit -->
| Verifiedfields =
| verifiedrevid =
| Watchedfields =
}}
|
{{Chembox Footer}} - (Chembox internal only; parameters entered in main {{Chembox}})
Set '=no' will hide the standard state notice
Allows a general note in the bottom box
Set '=no' will hide the infobox reference notice
Bot maintained
Do not edit, add or remove these fields
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टेम्पलेट:Chembox/doc/image-ordering
{{Chembox
| Name =
<!-- Row 1/7 -->
|ImageFile =
|ImageSize =
|ImageAlt =
|ImageCaption =
|ImageName =
<!-- Row 2/7 -->
|ImageFile1 =
|ImageSize1 =
|ImageAlt1 =
|ImageCaption1 =
|ImageName1 =
<!-- Row 3/7 -->
|ImageFileL1 =
|ImageSizeL1 =
|ImageAltL1 =
|ImageCaptionL1 =
|ImageNameL1 =
|ImageFileR1 =
|ImageSizeR1 =
|ImageAltR1 =
|ImageCaptionR1 =
|ImageNameR1 =
|ImageCaptionLR1=
<!-- etc. for Image 2, L2 R2, 3, L3 R3 -->
|ImageCaptionAll=
| <!-- ... (more Chembox parameters) -->
}}
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index example
| Identifiers
|
- Compounds
- lbl: comment
- lbl1: comment1
- lbl2: comment2
- lbl3: comment3
- lbl4: comment4
- lbl5: comment5
|
| RTECS number
|
{{{value}}}
|
| index_label =
| index1_label =
| index2_label =
| index3_label =
| index4_label =
| index5_label =
|
| index_comment =
| index1_comment =
| index2_comment =
| index3_comment =
| index4_comment =
| index5_comment =
|
CASNo
ChEBI
ChEMBL
ChemSpiderID
DrugBank
IUPHAR_ligand
Jmol
KEGG
PubChem
UNII
InChI, InChIKey
SMILES
DTXSID
3DMet
EC_number
RTECS
|
{{{CASNo|}}} {{{CASNo1|}}} {{{CASNo2|}}}
{{{CASNo3|}}} {{{CASNo4|}}} {{{CASNo5|}}}
{{{ChEBI|}}} {{{ChEBI1|}}} {{{ChEBI2|}}}
{{{ChEBI3|}}} {{{ChEBI4|}}} {{{ChEBI5|}}}
{{{ChEMBL|}}} {{{ChEMBL1|}}} {{{ChEMBL2|}}}
{{{ChEMBL3|}}} {{{ChEMBL4|}}} {{{ChEMBL5|}}}
{{{ChemSpiderID|}}} {{{ChemSpiderID1|}}} {{{ChemSpiderID2|}}}
{{{ChemSpiderID3|}}} {{{ChemSpiderID4|}}} {{{ChemSpiderID5|}}}
{{{DrugBank|}}} {{{DrugBank1|}}} {{{DrugBank2|}}}
{{{DrugBank3|}}} {{{DrugBank4|}}} {{{DrugBank5|}}}
{{{IUPHAR_ligand|}}} {{{IUPHAR_ligand1|}}} {{{IUPHAR_ligand2|}}}
{{{IUPHAR_ligand3|}}} {{{IUPHAR_ligand4|}}} {{{IUPHAR_ligand5|}}}
{{{Jmol|}}} {{{Jmol1|}}} {{{Jmol2|}}}
{{{Jmol3|}}} {{{Jmol4|}}} {{{Jmol5|}}}
{{{KEGG|}}} {{{KEGG1|}}} {{{KEGG2|}}}
{{{KEGG3|}}} {{{KEGG4|}}} {{{KEGG5|}}}
{{{PubChem|}}} {{{PubChem1|}}} {{{PubChem2|}}}
{{{PubChem3|}}} {{{PubChem4|}}} {{{PubChem5|}}}
{{{UNII|}}} {{{UNII1|}}} {{{UNII2|}}} {{{UNII3|}}}
{{{UNII4|}}} {{{UNII5|}}}
{{{InChI|}}}{{{InIKey|}}} {{{InChI1|}}}{{{InIKey1|}}} {{{InChI2|}}}{{{InChIKey2|}}}
{{{InChI3|}}}{{{InChIKey3|}}} {{{InChI4|}}}{{{InChIKey4|}}} {{{InChI5|}}}{{{InChIKey5|}}}
{{{SMILES|}}} {{{SMILES1|}}} {{{SMILES2|}}}
{{{SMILES3|}}} {{{SMILES4|}}} {{{SMILES5|}}}
{{{DTXSID|}}} {{{DTXSID1|}}} {{{DTXSID2|}}}
{{{DTXSID3|}}} {{{DTXSID4|}}} {{{DTXSID5|}}}
{{{3DMet|}}} {{{3DMet1|}}} {{{3DMet2|}}}
{{{3DMet3|}}} {{{3DMet4|}}} {{{3DMet5|}}}
{{{EC_number|}}} {{{EC_number1|}}} {{{EC_number2|}}}
{{{EC_number3|}}} {{{EC_number4|}}} {{{EC_number5|}}}
{{{RTECS|}}} {{{RTECS1|}}} {{{RTECS2|}}}
{{{RTECS3|}}} {{{RTECS4|}}} {{{RTECS5|}}}
|
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Four or less parameters are needed to present temperature data:
|
|MeltingPt=Decomposes when >
|MeltingPtC=50
|MeltingPt_ref=<ref>[www.example.com]</ref>
|MeltingPt_notes=My notes<ref>[www.chemspider.com]</ref>
|
Decomposes when >_50 °C (122 °F; 323 K)[1]_My notes[2]
|
|
The options for conversion:
|MeltingPtC=50
|MeltingPtF=50
|MeltingPtK=50
Temperature range:
|MeltingPtC=50 to 70
|MeltingPtF=50 to 70
|MeltingPtK=50 to 70
|
50 °C (122 °F; 323 K)
10 °C; 50 °F; 283 K
−223.2 °C; −369.7 °F; 50.0 K
50 से 70 °C (122 से 158 °F; 323 से 343 K)
10 से 21 °C; 50 से 70 °F; 283 से 294 K
−223.2 से −203.2 °C; −369.7 से −333.7 °F; 50.0 से 70.0 K
|
| Section = {{Chembox Properties
| MeltingPt =
| MeltingPtC =
| MeltingPtF =
| MeltingPtK =
| MeltingPt_ref =
| MeltingPt_notes =
| BoilingPt =
| BoilingPtC =
| BoilingPtF =
| BoilingPtK =
| BoilingPt_ref =
| BoilingPt_notes =
}}
|
{{Chembox Properties}} - all temperature parameters
Any text for melting point value
Temperature, number only. Can be a range: '100 to 200'
number, when in degrees Fahrenheit
number, when in kelvins
References (always shows, right after calculations or 'any text')
Notes (always shows last; can include references)
Any text for boiling point value
Temperature, number only. Can be a range: '100 to 200'
number, when in degrees Fahrenheit
number, when in kelvins
References (always shows, right after calculations or 'any text')
Notes (always shows last; can include references)
|
| Section = {{Chembox Hazards
| FlashPt =
| FlashPtC =
| FlashPtF =
| FlashPtK =
| FlashPt_ref =
| FlashPt_notes =
| AutoignitionPt =
| AutoignitionPtC =
| AutoignitionPtF =
| AutoignitionPtK =
| AutoignitionPt_ref =
| AutoignitionPt_notes =
}}
|
{{Chembox Hazards}} - all temperature parameters
Any text for Flash point value.
Temperature, number only. Can be a range: '100 to 200'
number, when in degrees Fahrenheit
number, when in kelvins
References (always shows, right after calculations or 'any text')
Notes (always shows last; can include references)
Any text for autoignition temperature value
Temperature, number only. Can be a range: '100 to 200'
number, when in degrees Fahrenheit
number, when in kelvins
References (always shows, right after calculations or 'any text')
Notes (always shows last; can include references)
|
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टेम्पलेट बिबरनलेख[बनाईं]