Geometry & MOs

Info

ID:	353235
PubChem CID:	127284415
Reduced:	O3N5C16H19 (1)
Stoich.:	A3B5C16D19 (1)
Weight, g/mol:	388.211055
ΔH_f, kcal/mol:	-63.6
Dipole, Da:	3.88
IP(EA), eV:	-9.45(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-oxo-1-[4-(6-oxo-1H-pyridine-3-carbonyl)piperazin-1-yl]propan-2-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC(=O)N2CCN(CC2)C(=O)C3=CNC(=O)C=C3

DOS

IR

Vibrations