Geometry & MOs

Info

ID:	238140
PubChem CID:	92729725
Reduced:	SN3O4C25H33 (1)
Stoich.:	AB3C4D25E33 (1)
Weight, g/mol:	485.234828
ΔH_f, kcal/mol:	-160.34
Dipole, Da:	6.72
IP(EA), eV:	-9.06(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-butyl-1-[3-[(4-propan-2-ylphenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCNC(=O)[C@H]1CCCN(C1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)C

DOS

IR

Vibrations