Geometry & MOs

Info

ID:	426889
PubChem CID:	135154360
Reduced:	NOC7H8 (4)
Stoich.:	ABC7D8 (4)
Weight, g/mol:	559.158659
ΔH_f, kcal/mol:	-86.7
Dipole, Da:	3.6
IP(EA), eV:	-8.69(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-[(4-chlorophenyl)methyl]-N-methylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(CCN(C2=O)CC3=CC=C(C=C3)OC)N=C1N4CCC(CC4)OC5=CN=C(C=C5)OC

DOS

IR

Vibrations