Geometry & MOs

Info

ID:	260612
PubChem CID:	103197419
Reduced:	ClN3O3C10H16 (1)
Stoich.:	AB3C3D10E16 (1)
Weight, g/mol:	254.093439
ΔH_f, kcal/mol:	-148.42
Dipole, Da:	9.28
IP(EA), eV:	-9.66(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-chloropyrimidin-4-yl)-N-methylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1CCCN(C1)C(=O)NC(=O)CCl

DOS

IR

Vibrations