Geometry & MOs

Info

ID:	275725
PubChem CID:	103817268
Reduced:	ClON3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	305.056719
ΔH_f, kcal/mol:	-27.33
Dipole, Da:	4.62
IP(EA), eV:	-9.67(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-methyl-N-(3-methylphenyl)-5-nitropyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC2(CC1)CCN(CC2)C(=O)C3=CN=C(C=N3)Cl

DOS

IR

Vibrations