Geometry & MOs

Info

ID:	227233
PubChem CID:	87560739
Reduced:	ClO3N4H21C25 (1)
Stoich.:	AB3C4D21E25 (1)
Weight, g/mol:	346.080377
ΔH_f, kcal/mol:	-2.82
Dipole, Da:	2.62
IP(EA), eV:	-8.45(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(ethoxymethoxy)-1,1,1,3,3,3-hexafluoropropan-2-yl]-4-(1-fluoroethenyl)benzene

Drug info:

PubChemData

Smile

CN1C=CC2=C1C=CC(=C2)N3/C(=C\4/C=C(C(=CC4=O)O)CCC5=CC=C(C=C5)Cl)/NNC3=O

DOS

IR

Vibrations