Geometry & MOs

Info

ID:	253140
PubChem CID:	103116279
Reduced:	BrON5H10C13 (1)
Stoich.:	ABC5D10E13 (1)
Weight, g/mol:	344.02727
ΔH_f, kcal/mol:	63.14
Dipole, Da:	5.05
IP(EA), eV:	-8.3(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-3-bromophenyl)-1-methylindazole-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C2=C3C=NC=CN3N=C2)Br)N

DOS

IR

Vibrations