Geometry & MOs

Info

ID:	224817
PubChem CID:	85402679
Reduced:	SiO3C21H34 (1)
Stoich.:	AB3C21D34 (1)
Weight, g/mol:	446.247516
ΔH_f, kcal/mol:	-166.38
Dipole, Da:	2.25
IP(EA), eV:	-8.97(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-ditert-butyl-6-[[(1-hydroxy-3-methylbutan-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one;oxovanadium;propan-2-ol

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC(CC=O)CC(=C)CCOCC1=CC=CC=C1

DOS

IR

Vibrations