| CAS Number | 852445-84-2 |
| Catalog Number | AG01FR70(AGN-PC-0UZ457) |
| Chemical Name | Chloro{1,3-bis[2,6-di-i-propylphenyl]-4,5-dihydroimidazol-2-ylidene}gold(I) |
| IUPAC Name | [1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ylidene]-chlorogold |
| InChI | InChI=1S/C27H38N2.Au.ClH/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;;/h9-14,18-21H,15-16H2,1-8H3;;1H/q;+1;/p-1 |
| InChI Key | KBTULXWTYFHSDZ-UHFFFAOYSA-M |
| MDL Number | MFCD09751413 |
| Molecular Formula | C27H38AuClN2 |
| Molecular Weight | 623.0236 |
| SMILES | Cl[Au-2]=C1N(CCN1C1=C(C=CC=C1C(C)C)C(C)C)C1=C(C=CC=C1C(C)C)C(C)C |
| Synonyms | 852445-84-2,
Chloro{1,3-bis[2,6-bis(1-methylethyl)phenyl]-4,5-dihydroimidazol-2-ylidene}gold(I),
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| Complexity | 522 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 622.238922g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 31 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 623g/mol |
| Monoisotopic Mass | 622.238922g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 6.5Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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