Geometry & MOs

Info

ID:	231377
PubChem CID:	87573582
Reduced:	ClN2H19C24 (1)
Stoich.:	AB2C19D24 (1)
Weight, g/mol:	288.098472
ΔH_f, kcal/mol:	101.09
Dipole, Da:	5.68
IP(EA), eV:	-9.18(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-[2-(2,2,3,3-tetrafluoropropoxy)ethoxy]pent-2-enoic acid

Drug info:

PubChemData

Smile

C1CC(C1)C2=CC=C(C=C2)C3=C(C=C4C=C(N=CC4=N3)Cl)C5=CC=CC=C5

DOS

IR

Vibrations