Geometry & MOs

Info

ID:	238031
PubChem CID:	92728888
Reduced:	N3O3C21H31 (1)
Stoich.:	A3B3C21D31 (1)
Weight, g/mol:	427.166269
ΔH_f, kcal/mol:	-154.17
Dipole, Da:	2.57
IP(EA), eV:	-9.03(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-[4-[(4-chlorobenzoyl)amino]benzoyl]-N-propan-2-ylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)[C@H]1CCCN(C1)C(=O)C2=CC=C(C=C2)NC(=O)C(C)(C)C

DOS

IR

Vibrations