Geometry & MOs

Info

ID:

277112

PubChem CID:

103826779

Reduced:

BrCl2N2O2H9C14 (1)

Stoich.:

AB2C2D2E9F14 (1)

Weight, g/mol:

348.96175

ΔHf, kcal/mol:

-48.84

Dipole, Da:

4.39

IP(EA), eV:

-9.64(-1.4)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-(1H-indazol-6-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C2=CC(=CC(=C2)Br)Cl)Cl)C(=O)N

DOS

IR

Vibrations