Geometry & MOs

Info

ID:	366047
PubChem CID:	127319363
Reduced:	SO3N4C19H30 (1)
Stoich.:	AB3C4D19E30 (1)
Weight, g/mol:	322.169271
ΔH_f, kcal/mol:	-105.73
Dipole, Da:	8.28
IP(EA), eV:	-8.66(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-fluoro-2-(oxolan-2-ylmethoxy)phenyl]-1-methylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NCCN2CCN(CC2)C(=O)C3CCCN3C

DOS

IR

Vibrations