2-ethenylcyclohepta-1,3,5-triene; methanal; molybdenum(2+); tetraphenylboranuide

Systemtic Name: 2-ethenylcyclohepta-1,3,5-triene; methanal; molybdenum(2+); tetraphenylboranuide Openeye Name: formaldehyde; molybdenum(2+); tetraphenylboranuide; 2-vinylcyclohepta-1,3,5-triene CAS Name: 2-ethenylcyclohepta-1,3,5-triene; formaldehyde; molybdenum(2+); tetraphenylboranuide IUPAC Name: 2-ethenylcyclohepta-1,3,5-triene; formaldehyde; molybdenum(2+); tetraphenylboranuide Traditional Name: formaldehyde; molybdenum(2+); tetraphenylboranuide; 2-vinylcyclohepta-1,3,5-triene Formula: C36H35BMoO3 MolecularWeight: 622.4123

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C=CC1=[C-]CC=CC=C1.C=O.C=O.C=O.[Mo+2]

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C=CC1=[C-]CC=CC=C1.C=O.C=O.C=O.[Mo+2]

InChI

InChI=1S/C24H20B.C9H9.3CH2O.Mo/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-2-9-7-5-3-4-6-8-9;3*1-2;/h1-20H;2-5,7H,1,6H2;3*1H2;/q2*-1;;;;+2