Geometry & MOs

Info

ID:	331225
PubChem CID:	127248632
Reduced:	N3O3C17H25 (1)
Stoich.:	A3B3C17D25 (1)
Weight, g/mol:	396.183127
ΔH_f, kcal/mol:	-116.96
Dipole, Da:	5.12
IP(EA), eV:	-9.12(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylpropyl)-2-(1-morpholin-4-ylsulfonylpyrrolidin-3-yl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CNC(=O)C1=C(N=CC=C1)C2CCN(C2)C(=O)COC

DOS

IR

Vibrations