tert-butylimino-[2,6-di(propan-2-yl)phenyl]imino-molybdenum(2+); 2-methanidylpropan-2-ylbenzene

Systemtic Name: tert-butylimino-[2,6-di(propan-2-yl)phenyl]imino-molybdenum(2+); 2-methanidylpropan-2-ylbenzene Openeye Name: tert-butylimino-(2,6-diisopropylphenyl)imino-molybdenum(2+); (1-methanidyl-1-methyl-ethyl)benzene CAS Name: tert-butylimino-[2,6-di(propan-2-yl)phenyl]iminomolybdenum(2+); 2-methanidylpropan-2-ylbenzene IUPAC Name: tert-butylimino-[2,6-di(propan-2-yl)phenyl]iminomolybdenum(2+); 2-methanidylpropan-2-ylbenzene Traditional Name: tert-butylimino-(2,6-diisopropylphenyl)imino-molybdenum(2+); (1-methanidyl-1-methyl-ethyl)benzene Formula: C36H52MoN2 MolecularWeight: 608.75148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)N=[Mo+2]=NC(C)(C)C.CC(C)([CH2-])C1=CC=CC=C1.CC(C)([CH2-])C1=CC=CC=C1

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)N=[Mo+2]=NC(C)(C)C.CC(C)([CH2-])C1=CC=CC=C1.CC(C)([CH2-])C1=CC=CC=C1

InChI

InChI=1S/C12H17N.2C10H13.C4H9N.Mo/c1-8(2)10-6-5-7-11(9(3)4)12(10)13;2*1-10(2,3)9-7-5-4-6-8-9;1-4(2,3)5;/h5-9H,1-4H3;2*4-8H,1H2,2-3H3;1-3H3;/q;2*-1;;+2