Geometry & MOs

Info

ID:	188239
PubChem CID:	77687019
Reduced:	N4O4C19H22 (1)
Stoich.:	A4B4C19D22 (1)
Weight, g/mol:	384.179755
ΔH_f, kcal/mol:	-111.06
Dipole, Da:	5.46
IP(EA), eV:	-9.25(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(benzylcarbamoyl)cyclopent-2-ene-1-carboxylic acid;2-cyanopyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2CC(C(=O)O)N.C1=C(NC=N1)CC(C(=O)O)N

DOS

IR

Vibrations