Geometry & MOs

Info

ID:	45372
PubChem CID:	10512188
Reduced:	BrF2C6H9 (1)
Stoich.:	AB2C6D9 (1)
Weight, g/mol:	200.17763
ΔH_f, kcal/mol:	-106.75
Dipole, Da:	1.78
IP(EA), eV:	-10.36(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,5-trimethylnon-8-ene-3,5-diol

Drug info:

PubChemData

Smile

C=CCCC(CBr)(F)F

DOS

IR

Vibrations