Geometry & MOs

Info

ID:	292346
PubChem CID:	114917282
Reduced:	FCl2N3O3H6C12 (1)
Stoich.:	AB2C3D3E6F12 (1)
Weight, g/mol:	270.007516
ΔH_f, kcal/mol:	-39.71
Dipole, Da:	5.71
IP(EA), eV:	-10.01(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dichloro-N-(1-methylpyrazol-4-yl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)C2=CC(=NC=C2Cl)Cl)F

DOS

IR

Vibrations