Geometry & MOs

Info

ID:	427153
PubChem CID:	135155743
Reduced:	ON4H32C33 (1)
Stoich.:	AB4C32D33 (1)
Weight, g/mol:	501.156767
ΔH_f, kcal/mol:	82.52
Dipole, Da:	5.41
IP(EA), eV:	-9.08(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-2-chlorobenzoyl]piperazin-2-one

Drug info:

PubChemData

Smile

CCC(C1=CC(=CC=C1)C(=O)N2CC3=CC=CC=C3C2)N4CC(N=C4N)(C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations