Geometry & MOs

Info

ID:	367118
PubChem CID:	127323389
Reduced:	SO3N4C19H30 (1)
Stoich.:	AB3C4D19E30 (1)
Weight, g/mol:	265.179027
ΔH_f, kcal/mol:	-111.41
Dipole, Da:	6.33
IP(EA), eV:	-8.8(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)-2-azabicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCN(CC1)C(=O)NCC2CCCN2CC3=CC=CC=C3

DOS

IR

Vibrations