Geometry & MOs

Info

ID:	64700
PubChem CID:	29203875
Reduced:	NO2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	332.209993
ΔH_f, kcal/mol:	-172.36
Dipole, Da:	4.64
IP(EA), eV:	-8.29(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-(3-butoxypropyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCOCCCNC(=O)[C@@H]1CC(=O)N(C1)C2=CC=CC=C2OCC

DOS

IR

Vibrations