Geometry & MOs

Info

ID:	379833
PubChem CID:	134465017
Reduced:	F3H21C25 (1)
Stoich.:	A3B21C25 (1)
Weight, g/mol:	360.133714
ΔH_f, kcal/mol:	-28.97
Dipole, Da:	3.73
IP(EA), eV:	-8.92(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethenyl-5-(6-ethoxy-3,4,5-trifluorobiphenylen-2-yl)oxane

Drug info:

PubChemData

Smile

CCCC1=C(C2=C3C(=C2C=C1)C=C(C(=C3F)F)C4=CC=C(C=C4)CCC=C)F

DOS

IR

Vibrations