Geometry & MOs

Info

ID:	54410
PubChem CID:	17153678
Reduced:	N2O2C13H16 (2)
Stoich.:	A2B2C13D16 (2)
Weight, g/mol:	421.236542
ΔH_f, kcal/mol:	-159.13
Dipole, Da:	4.05
IP(EA), eV:	-8.92(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butyl-N-[4-[ethyl-(3-methylphenyl)carbamoyl]phenyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NC(C)C

DOS

IR

Vibrations