Geometry & MOs

Info

ID:	418194
PubChem CID:	135103796
Reduced:	NOC5H6 (4)
Stoich.:	ABC5D6 (4)
Weight, g/mol:	361.225308
ΔH_f, kcal/mol:	-123.1
Dipole, Da:	5.36
IP(EA), eV:	-8.72(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4S)-4-benzyl-3-hydroxy-1-(2-propylpentanoyl)piperidine-4-carboxylic acid

Drug info:

PubChemData

Smile

C1CN(CCN(C1)C(=O)CN2C=CC3=CC=CC=C32)C(=O)CN4CCOC4=O

DOS

IR

Vibrations