Geometry & MOs

Info

ID:	50750
PubChem CID:	12013338
Reduced:	FNSO2C19H20 (1)
Stoich.:	ABCD2E19F20 (1)
Weight, g/mol:	194.110693
ΔH_f, kcal/mol:	-85.52
Dipole, Da:	6.33
IP(EA), eV:	-8.6(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-1-fluorohex-1-en-2-yl]phenol

Drug info:

PubChemData

Smile

CCC(C)C1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C)F

DOS

IR

Vibrations