Geometry & MOs

Info

ID:	172106
PubChem CID:	75468060
Reduced:	SCl2N3O4C14H15 (1)
Stoich.:	AB2C3D4E14F15 (1)
Weight, g/mol:	391.085432
ΔH_f, kcal/mol:	-112.32
Dipole, Da:	5.09
IP(EA), eV:	-9.46(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(cyclopentanecarbonylamino)methyl]-N-(4,5-dichloropyridin-2-yl)benzamide

Drug info:

PubChemData

Smile

CC(C)(C)NS(=O)(=O)C1=CC=C(O1)C(=O)NC2=NC=C(C(=C2)Cl)Cl

DOS

IR

Vibrations