Geometry & MOs

Info

ID:	253424
PubChem CID:	103118357
Reduced:	BrON4H13C15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	343.03202
ΔH_f, kcal/mol:	54.65
Dipole, Da:	2.15
IP(EA), eV:	-9.61(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-3-methylphenyl)-1-methylindazole-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=C1)Br)NC(=O)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations