Geometry & MOs

Info

ID:	274766
PubChem CID:	103811545
Reduced:	ClON3C12H18 (1)
Stoich.:	ABC3D12E18 (1)
Weight, g/mol:	281.12949
ΔH_f, kcal/mol:	-50.45
Dipole, Da:	3.05
IP(EA), eV:	-9.09(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-N-(6-chloro-5-methylpyridin-3-yl)-3-methylcyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1Cl)NC(=O)CCC(C)(C)N

DOS

IR

Vibrations