Geometry & MOs

Info

ID:	223702
PubChem CID:	85335444
Reduced:	N3O3C31H33 (1)
Stoich.:	A3B3C31D33 (1)
Weight, g/mol:	496.132048
ΔH_f, kcal/mol:	-36.91
Dipole, Da:	5.63
IP(EA), eV:	-8.81(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4,5-bis(4-chlorophenyl)-2-(3,5-dimethoxyphenyl)-4,5-dihydroimidazol-1-yl]-2-methylpropan-1-one

Drug info:

PubChemData

Smile

CN1C(=O)CC2=CC=CC=C2C13CCC(NC3)CCC=C4C5=C(COC6=C4C=C(C=C6)OC)N=CC=C5

DOS

IR

Vibrations