Geometry & MOs

Info

ID:	416407
PubChem CID:	135089420
Reduced:	O3N4C17H22 (1)
Stoich.:	A3B4C17D22 (1)
Weight, g/mol:	367.178358
ΔH_f, kcal/mol:	-59.1
Dipole, Da:	7.2
IP(EA), eV:	-8.96(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-3-benzyl-4-hydroxy-1-[2-(3-methylphenyl)acetyl]piperidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CN(C)CC(=O)NCC2=CC=C(C=C2)NC(=O)C

DOS

IR

Vibrations