Geometry & MOs

Info

ID:	80712
PubChem CID:	49836254
Reduced:	NBr2H5C9 (1)
Stoich.:	AB2C5D9 (1)
Weight, g/mol:	300.89248
ΔH_f, kcal/mol:	80.93
Dipole, Da:	3.38
IP(EA), eV:	-10.1(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-dibromo-2-(2-methylphenyl)prop-2-enenitrile

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=C(Br)Br)C#N

DOS

IR

Vibrations