Geometry & MOs

Info

ID:	318110
PubChem CID:	126648995
Reduced:	ClNO4H8C16 (1)
Stoich.:	ABC4D8E16 (1)
Weight, g/mol:	252.98507
ΔH_f, kcal/mol:	-67.38
Dipole, Da:	6.33
IP(EA), eV:	-9.91(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-methylindazole-6-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)C(=O)O)O)C2=CC(=CC3=C2OC(=C3)Cl)C#N

DOS

IR

Vibrations