Geometry & MOs

Info

ID:	224567
PubChem CID:	85344874
Reduced:	O2F3C11H11 (1)
Stoich.:	A2B3C11D11 (1)
Weight, g/mol:	244.14633
ΔH_f, kcal/mol:	-152.87
Dipole, Da:	2.87
IP(EA), eV:	-10.19(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hexylidene-5-phenyloxolan-2-one

Drug info:

PubChemData

Smile

CC(=C)C(C1=CC(=CC=C1)C(F)(F)F)OO

DOS

IR

Vibrations