Geometry & MOs

Info

ID:	229882
PubChem CID:	87569433
Reduced:	FNCl2H2O2C6 (1)
Stoich.:	ABC2D2E2F6 (1)
Weight, g/mol:	321.90271
ΔH_f, kcal/mol:	-101.08
Dipole, Da:	4.71
IP(EA), eV:	-10.8(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,2-dibromoethenyl)-2-ethoxyphenol

Drug info:

PubChemData

Smile

C1=C(C(=C(N=C1Cl)Cl)C(=O)O)F

DOS

IR

Vibrations