Geometry & MOs

Info

ID:	63493
PubChem CID:	26758482
Reduced:	ClNF2O3H14C17 (1)
Stoich.:	ABC2D3E14F17 (1)
Weight, g/mol:	494.117939
ΔH_f, kcal/mol:	-194.38
Dipole, Da:	6.99
IP(EA), eV:	-8.96(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2-chlorophenyl)sulfamoyl]-4-piperidin-1-ylphenyl]-4-cyanobenzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)NC(=O)[C@H](C)OC(=O)C2=C(C=C(C=C2)F)F

DOS

IR

Vibrations