Geometry & MOs

Info

ID:	275672
PubChem CID:	103817010
Reduced:	ClO2N4H9C12 (1)
Stoich.:	AB2C4D9E12 (1)
Weight, g/mol:	313.006575
ΔH_f, kcal/mol:	-15.03
Dipole, Da:	3.71
IP(EA), eV:	-9.43(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(2,4-difluorophenyl)-5-nitropyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)N)NC(=O)C2=CN=C(C=N2)Cl

DOS

IR

Vibrations