Geometry & MOs

Info

ID:	158477
PubChem CID:	56463775
Reduced:	SN2O6C19H28 (1)
Stoich.:	AB2C6D19E28 (1)
Weight, g/mol:	418.137399
ΔH_f, kcal/mol:	-245.88
Dipole, Da:	9.38
IP(EA), eV:	-8.98(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(difluoromethoxy)benzoyl]-N-(2-ethylsulfonylethyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1CCN(CC1)C(=O)C2=CC(=CC(=C2)OC)OC

DOS

IR

Vibrations