GZ6
Guanidinium
Created: | 2020-07-29 |
Last modified: | 2020-09-09 |
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Chemical Details | |
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Formal Charge | 1 |
Atom Count | 10 |
Chiral Atom Count | 0 |
Bond Count | 9 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | Guanidinium |
Systematic Name (OpenEye OEToolkits) | bis(azanyl)methylideneazanium |
Formula | C H6 N3 |
Molecular Weight | 60.078 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C(\N)(N)=[NH2+] |
SMILES | CACTVS | 3.385 | NC(N)=[NH2+] |
SMILES | OpenEye OEToolkits | 2.0.7 | C(=[NH2+])(N)N |
Canonical SMILES | CACTVS | 3.385 | NC(N)=[NH2+] |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C(=[NH2+])(N)N |
InChI | InChI | 1.03 | InChI=1S/CH5N3/c2-1(3)4/h(H5,2,3,4)/p+1 |
InChIKey | InChI | 1.03 | ZRALSGWEFCBTJO-UHFFFAOYSA-O |
Related Resource References
Resource Name | Reference |
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PubChem | 5180888, 3032808, 32838 |
ChEBI | CHEBI:30087 |
CCDC/CSD | AMEGAC01, ALETAO, BACDOY01, AMEGAC, AYATIF, ALETAO01, APOSII, AJICIG, APONUP, APORUT, BAGPEE01, ABUNOB, APOQIG, APONEZ, BAWYAC, APOQUS, APONOJ, APONOJ02, APOSEE, BAKFAV, APITOK, ADEGUO, AJAQOU, APOSAA, APOQAY, AYOYIX, APOQEC, ALIWID, APORIH, APORIH02, ANENUD, APOMIC, BACDOY, ANENUD01, ANEPAL, AJOTEY, BACDIS, APOSOO, APOMAU, ANENOX, BANDAV, APOMEY, BAYXII10, BAYXII, AWEGIV, AKAXES, AXOSIS, ANIVAX |
COD | 1008449, 7104455 |