Geometry & MOs

Info

ID:	381198
PubChem CID:	134971854
Reduced:	OC8H14 (2)
Stoich.:	AB8C14 (2)
Weight, g/mol:	258.12315
ΔH_f, kcal/mol:	-149.83
Dipole, Da:	2.46
IP(EA), eV:	-10.16(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E,5S)-6,6,6-trifluoro-5-methylhex-3-enoxy]methylbenzene

Drug info:

PubChemData

Smile

CC1CCC2CC(C(CC2(C1C)C)C)OC(=O)C

DOS

IR

Vibrations