Geometry & MOs

Info

ID:	175757
PubChem CID:	75943570
Reduced:	SN2O7C19H28 (1)
Stoich.:	AB2C7D19E28 (1)
Weight, g/mol:	472.166808
ΔH_f, kcal/mol:	-277.23
Dipole, Da:	5.7
IP(EA), eV:	-8.88(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[4-[[(4-acetylphenyl)sulfonylamino]methyl]benzoyl]piperidine-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1CCCCN1C(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations