Geometry & MOs

Info

ID:	276872
PubChem CID:	103825518
Reduced:	NO3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	228.147393
ΔH_f, kcal/mol:	-141.71
Dipole, Da:	7.05
IP(EA), eV:	-9.39(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(4-hydroxy-2,2-dimethylbutyl)-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)NCC(C)(C)CCO)O

DOS

IR

Vibrations