Geometry & MOs

Info

ID:	140213
PubChem CID:	52663023
Reduced:	FO3N4C21H27 (1)
Stoich.:	AB3C4D21E27 (1)
Weight, g/mol:	406.111791
ΔH_f, kcal/mol:	-155.7
Dipole, Da:	8.38
IP(EA), eV:	-8.64(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-phenyl-N-propan-2-yl-5-pyrrolidin-1-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=C(C=C(C=C2)NC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)F)C

DOS

IR

Vibrations