[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]zinc; phenylmethanol

Systemtic Name: [1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]zinc; phenylmethanol Openeye Name: [1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]zinc; phenylmethanol CAS Name: [1,3-bis(2,4,6-trimethylphenyl)-2-imidazolylidene]zinc; phenylmethanol IUPAC Name: [1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]zinc; phenylmethanol Traditional Name: (1,3-dimesityl-4-imidazolin-2-ylidene)zinc; phenylmethanol Formula: C70H80N4O4Zn2 MolecularWeight: 1172.2266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C=CN(C2=[Zn])C3=C(C=C(C=C3C)C)C)C.CC1=CC(=C(C(=C1)C)N2C=CN(C2=[Zn])C3=C(C=C(C=C3C)C)C)C.C1=CC=C(C=C1)CO.C1=CC=C(C=C1)CO.C1=CC=C(C=C1)CO.C1=CC=C(C=C1)CO

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C=CN(C2=[Zn])C3=C(C=C(C=C3C)C)C)C.CC1=CC(=C(C(=C1)C)N2C=CN(C2=[Zn])C3=C(C=C(C=C3C)C)C)C.C1=CC=C(C=C1)CO.C1=CC=C(C=C1)CO.C1=CC=C(C=C1)CO.C1=CC=C(C=C1)CO

InChI

InChI=1S/2C21H24N2.4C7H8O.2Zn/c2*1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;4*8-6-7-4-2-1-3-5-7;;/h2*7-12H,1-6H3;4*1-5,8H,6H2;;