Geometry & MOs

Info

ID:	375851
PubChem CID:	134221843
Reduced:	FNO3C21H22 (1)
Stoich.:	ABC3D21E22 (1)
Weight, g/mol:	116.063743
ΔH_f, kcal/mol:	-157.74
Dipole, Da:	6.02
IP(EA), eV:	-8.55(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-4-fluorohexa-3,5-dien-3-ol

Drug info:

PubChemData

Smile

CC1=CC2=C(CCN2)C(=C1CC(=O)O)C3=CC(=C4C(=C3C)CCCO4)F

DOS

IR

Vibrations