Geometry & MOs

Info

ID:	156510
PubChem CID:	56370930
Reduced:	ClSN4O4C23H29 (1)
Stoich.:	ABC4D4E23F29 (1)
Weight, g/mol:	435.101955
ΔH_f, kcal/mol:	-139.19
Dipole, Da:	8.09
IP(EA), eV:	-8.72(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(2-chloro-5-methylsulfonylbenzoyl)amino]phenyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)N(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NC2=CC=CC=C2N3CCC(CC3)C(=O)N

DOS

IR

Vibrations