Geometry & MOs

Info

ID:	238183
PubChem CID:	92729768
Reduced:	SN3O4C26H35 (1)
Stoich.:	AB3C4D26E35 (1)
Weight, g/mol:	485.234828
ΔH_f, kcal/mol:	-161.24
Dipole, Da:	9.09
IP(EA), eV:	-9.32(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-[3-[(4-tert-butylphenyl)sulfonylamino]benzoyl]-N-propylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations