Geometry & MOs

Info

ID:	423575
PubChem CID:	135119762
Reduced:	N6O6C33H46 (1)
Stoich.:	A6B6C33D46 (1)
Weight, g/mol:	363.171355
ΔH_f, kcal/mol:	-248.33
Dipole, Da:	7.03
IP(EA), eV:	-8.85(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N[C@H](CN(CC(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC2=CC=C(C=C2)OC)CC(C)C)C(=O)CC3=CN=CC=C3)C(C)C

DOS

IR

Vibrations