Geometry & MOs

Info

ID:	399519
PubChem CID:	135040701
Reduced:	Cl2O2C13H14 (1)
Stoich.:	A2B2C13D14 (1)
Weight, g/mol:	325.89403
ΔH_f, kcal/mol:	-84.51
Dipole, Da:	4.36
IP(EA), eV:	-9.68(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4,4-dibromobut-3-en-2-yl)-1,3-difluorobenzene

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)/C=C(/CCCCl)\Cl

DOS

IR

Vibrations