Geometry & MOs

Info

ID:	318150
PubChem CID:	126649086
Reduced:	ClFN2O3H10C14 (1)
Stoich.:	ABC2D3E10F14 (1)
Weight, g/mol:	293.080041
ΔH_f, kcal/mol:	-63.29
Dipole, Da:	2.25
IP(EA), eV:	-9.73(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-cyano-2-methylindazol-4-yl) 2-hydroxybenzoate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)Cl)F

DOS

IR

Vibrations