Geometry & MOs

Info

ID:	408297
PubChem CID:	135081061
Reduced:	OC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	288.03366
ΔH_f, kcal/mol:	-78.66
Dipole, Da:	5.49
IP(EA), eV:	-9.09(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-1-bromo-1-(2,2,2-trifluoroethoxy)oct-1-ene

Drug info:

PubChemData

Smile

CCC[C@@H]1[C@H](C(=CC=CC1=O)OC)C

DOS

IR

Vibrations