Geometry & MOs

Info

ID:	427743
PubChem CID:	135161884
Reduced:	F2O2N3C13H23 (1)
Stoich.:	A2B2C3D13E23 (1)
Weight, g/mol:	282.122007
ΔH_f, kcal/mol:	-162.08
Dipole, Da:	5.41
IP(EA), eV:	-8.82(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-2-[3-[(3Z,5Z)-3-fluorohepta-1,3,5-trien-4-yl]phenyl]benzene

Drug info:

PubChemData

Smile

CN1CCC(CC1)N2CC(CC2C(=O)N(C)OC)(F)F

DOS

IR

Vibrations