Geometry & MOs

Info

ID:	200799
PubChem CID:	79446638
Reduced:	Br2Cl3H13C16 (1)
Stoich.:	A2B3C13D16 (1)
Weight, g/mol:	433.9583
ΔH_f, kcal/mol:	12.64
Dipole, Da:	2.44
IP(EA), eV:	-9.51(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-bromo-2-(bromomethyl)-2-(2-chlorophenyl)propyl]-1-ethyl-3-methylpyrazole

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(CC2=C(C=C(C=C2)Cl)Cl)(CBr)CBr)Cl

DOS

IR

Vibrations