Home Halogens (1,3-Bis(2,6-diisopropylphenyl)-1,3-dihydro-2H-imidazol-2-ylidene)(chloro)gold

(1,3-Bis(2,6-diisopropylphenyl)-1,3-dihydro-2H-imidazol-2-ylidene)(chloro)gold

CAS No.:
852445-83-1
Catalog Number:
AG003OSV
Molecular Formula:
C27H36AuClN2
Molecular Weight:
621.0077
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Product Description
Catalog Number:
AG003OSV
Chemical Name:
(1,3-Bis(2,6-diisopropylphenyl)-1,3-dihydro-2H-imidazol-2-ylidene)(chloro)gold
CAS Number:
852445-83-1
Molecular Formula:
C27H36AuClN2
Molecular Weight:
621.0077
MDL Number:
MFCD09839143
IUPAC Name:
[1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-2-ylidene]-chlorogold
InChI:
InChI=1S/C27H36N2.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;;/h9-16,18-21H,1-8H3;;1H/q;+1;/p-1
InChI Key:
CNJQLSINQGKZAW-UHFFFAOYSA-M
SMILES:
CC(c1cccc(c1n1ccn(c1=[Au]Cl)c1c(cccc1C(C)C)C(C)C)C(C)C)C
Properties
Complexity:
559  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
620.223g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
621.016g/mol
Monoisotopic Mass:
620.223g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties