Geometry & MOs

Info

ID:	407574
PubChem CID:	135080322
Reduced:	FO2C10H11 (1)
Stoich.:	AB2C10D11 (1)
Weight, g/mol:	184.069971
ΔH_f, kcal/mol:	-115.56
Dipole, Da:	0.38
IP(EA), eV:	-9.53(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-fluoro-3-(3-fluorophenyl)but-3-en-1-ol

Drug info:

PubChemData

Smile

COC(=O)[C@H](CC1=CC=CC=C1)F

DOS

IR

Vibrations