Geometry & MOs

Info

ID:	318711
PubChem CID:	126652799
Reduced:	O7C10H13 (2)
Stoich.:	A7B10C13 (2)
Weight, g/mol:	240.131429
ΔH_f, kcal/mol:	-546.82
Dipole, Da:	1.14
IP(EA), eV:	-10.42(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-4-[(E)-2-(4-propan-2-ylphenyl)ethenyl]benzene

Drug info:

PubChemData

Smile

C=CCOC(=O)OCCOC(=O)OC1COC2C1OCC2OC(=O)OCCOC(=O)OCC=C

DOS

IR

Vibrations