Geometry & MOs

Info

ID:	390526
PubChem CID:	134999557
Reduced:	OC8H8 (2)
Stoich.:	AB8C8 (2)
Weight, g/mol:	286.15445
ΔH_f, kcal/mol:	-30.14
Dipole, Da:	2.27
IP(EA), eV:	-9.27(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,1S)-1-[4-(trifluoromethyl)phenyl]non-2-en-1-ol

Drug info:

PubChemData

Smile

C1C=C2COCC2=C3C1(COC3)C4=CC=CC=C4

DOS

IR

Vibrations