Geometry & MOs

Info

ID:	411910
PubChem CID:	135084766
Reduced:	OC14H22 (1)
Stoich.:	AB14C22 (1)
Weight, g/mol:	407.77947
ΔH_f, kcal/mol:	-19.32
Dipole, Da:	3.32
IP(EA), eV:	-9.72(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-2-(2,2-dibromoethenyl)-4-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

CCCCC/C=C/C(=O)C(C)CC#CC

DOS

IR

Vibrations