Geometry & MOs

Info

ID:	254796
PubChem CID:	103127747
Reduced:	BrFN4H10C13 (1)
Stoich.:	ABC4D10E13 (1)
Weight, g/mol:	333.02769
ΔH_f, kcal/mol:	61.36
Dipole, Da:	1.63
IP(EA), eV:	-9.4(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromo-2-fluorophenyl)-(1-methylindazol-3-yl)methanamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Br)C(C2=C3C=NC=CN3N=C2)N)F

DOS

IR

Vibrations