Geometry & MOs

Info

ID:	399170
PubChem CID:	135038434
Reduced:	C13H18 (1)
Stoich.:	A13B18 (1)
Weight, g/mol:	242.077679
ΔH_f, kcal/mol:	40.42
Dipole, Da:	1.29
IP(EA), eV:	-8.68(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-3-fluoro-5-(phenylmethoxymethyl)thiolan-2-ol

Drug info:

PubChemData

Smile

CC/C(=C/C1=C(CCCC1)C#C)/C

DOS

IR

Vibrations