Geometry & MOs

Info

ID:	79210
PubChem CID:	49747423
Reduced:	S2N3O3C22H25 (1)
Stoich.:	A2B3C3D22E25 (1)
Weight, g/mol:	482.1334
ΔH_f, kcal/mol:	-47.44
Dipole, Da:	6.88
IP(EA), eV:	-8.88(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzoyl-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

C1CCN(C(C1)CCNC(=O)C2=CC=C(C=C2)N3C=CC=C3)S(=O)(=O)C4=CC=CS4

DOS

IR

Vibrations