Geometry & MOs

Info

ID:	353514
PubChem CID:	127285091
Reduced:	O3N4C20H30 (1)
Stoich.:	A3B4C20D30 (1)
Weight, g/mol:	269.173942
ΔH_f, kcal/mol:	-112.02
Dipole, Da:	8.68
IP(EA), eV:	-8.99(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-morpholin-4-ylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)C(=O)N(C)C)C(=O)NCC2(CCOCC2)N3CCCC3

DOS

IR

Vibrations