Geometry & MOs

Info

ID:	351276
PubChem CID:	127280164
Reduced:	N3O3C20H35 (1)
Stoich.:	A3B3C20D35 (1)
Weight, g/mol:	383.232125
ΔH_f, kcal/mol:	-164.31
Dipole, Da:	2.14
IP(EA), eV:	-8.86(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(5-cyano-6-methylpyridine-2-carbonyl)piperazin-1-yl]-N-cyclohexyl-N-methylacetamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)CN2CCN(CC2)C(=O)CCC3CCCO3

DOS

IR

Vibrations