Geometry & MOs

Info

ID:	238044
PubChem CID:	92728932
Reduced:	N3O3C23H27 (1)
Stoich.:	A3B3C23D27 (1)
Weight, g/mol:	455.220892
ΔH_f, kcal/mol:	-104.49
Dipole, Da:	7.2
IP(EA), eV:	-9.13(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-(4-benzamidobenzoyl)-N-(2-phenylethyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)C(=O)N2CCC[C@@H](C2)C(=O)NCCC3=CC=CC=C3

DOS

IR

Vibrations