Geometry & MOs

Info

ID:	357088
PubChem CID:	127293158
Reduced:	O2N3C21H31 (1)
Stoich.:	A2B3C21D31 (1)
Weight, g/mol:	382.172642
ΔH_f, kcal/mol:	-87.99
Dipole, Da:	1.74
IP(EA), eV:	-8.88(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-3-(4-fluorophenyl)sulfonylbutanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC=C(C=C1)C(=O)NC2CCN(C2)C3CCCC3

DOS

IR

Vibrations