2,6-dimethylphenol; (3,5-dimethylphenyl)-propan-2-yl-azanide; molybdenum; phosphanylphosphane

Systemtic Name: 2,6-dimethylphenol; (3,5-dimethylphenyl)-propan-2-yl-azanide; molybdenum; phosphanylphosphane Openeye Name: 2,6-dimethylphenol; (3,5-dimethylphenyl)-isopropyl-azanide; molybdenum; phosphanylphosphane CAS Name: 2,6-dimethylphenol; (3,5-dimethylphenyl)-propan-2-ylazanide; molybdenum; phosphinophosphine IUPAC Name: 2,6-dimethylphenol; (3,5-dimethylphenyl)-propan-2-ylazanide; molybdenum; phosphanylphosphane Traditional Name: (3,5-dimethylphenyl)-isopropyl-azanide; molybdenum; phosphinophosphine; 2,6-xylenol Formula: C54H76Mo2N2O4P2-2 MolecularWeight: 1071.019762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)O.CC1=C(C(=CC=C1)C)O.CC1=C(C(=CC=C1)C)O.CC1=C(C(=CC=C1)C)O.CC1=CC(=CC(=C1)[N-]C(C)C)C.CC1=CC(=CC(=C1)[N-]C(C)C)C.PP.[Mo].[Mo]

Isomeric SMILES

CC1=C(C(=CC=C1)C)O.CC1=C(C(=CC=C1)C)O.CC1=C(C(=CC=C1)C)O.CC1=C(C(=CC=C1)C)O.CC1=CC(=CC(=C1)[N-]C(C)C)C.CC1=CC(=CC(=C1)[N-]C(C)C)C.PP.[Mo].[Mo]

InChI

InChI=1S/2C11H16N.4C8H10O.2Mo.H4P2/c2*1-8(2)12-11-6-9(3)5-10(4)7-11;4*1-6-4-3-5-7(2)8(6)9;;;1-2/h2*5-8H,1-4H3;4*3-5,9H,1-2H3;;;1-2H2/q2*-1;;;;;;;