Geometry & MOs

Info

ID:	174115
PubChem CID:	75725512
Reduced:	ClN3O5C25H30 (1)
Stoich.:	AB3C5D25E30 (1)
Weight, g/mol:	513.203049
ΔH_f, kcal/mol:	-180.85
Dipole, Da:	7.08
IP(EA), eV:	-8.4(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-N-[2-(cyclohexylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C(C1=CC(=C(C=C1)OC)OC)N(C2=CC(=CC=C2)Cl)C(=O)C3CCC(=O)N3

DOS

IR

Vibrations