Geometry & MOs

Info

ID:	27993
PubChem CID:	824667
Reduced:	ClN2H7C10 (1)
Stoich.:	AB2C7D10 (1)
Weight, g/mol:	315.90337
ΔH_f, kcal/mol:	66.49
Dipole, Da:	1.2
IP(EA), eV:	-9.58(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dibromo-3-methyl-1-phenylpyrazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC=CN=C2Cl

DOS

IR

Vibrations