Geometry & MOs

Info

ID:	159737
PubChem CID:	57288684
Reduced:	O2N3C31H33 (1)
Stoich.:	A2B3C31D33 (1)
Weight, g/mol:	228.147393
ΔH_f, kcal/mol:	-9.39
Dipole, Da:	3.57
IP(EA), eV:	-9.26(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-hydroxyethyl)-2-(2-oxopyrrolidin-1-yl)pentanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(=O)N2CC[C@@H](C[C@@H]2[C@@H](C3=CC=CC=C3)O)NCC4=CC=NC5=CC=CC=C45)C

DOS

IR

Vibrations