Geometry & MOs

Info

ID:	325183
PubChem CID:	126681827
Reduced:	NO3C28H48 (1)
Stoich.:	AB3C28D48 (1)
Weight, g/mol:	330.033821
ΔH_f, kcal/mol:	-130.29
Dipole, Da:	1.36
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.898220
Charge, e:	0

Chem-info

IUPAC name:

4-[[2,3,3,3-tetrafluoro-2-(2,2,2-trifluoroethoxy)propoxy]methyl]-1,3-dioxolan-2-one

Drug info:

PubChemData

Smile

CCCCCCCCC1=CC=C(C=C1)OCCOCC[N+]2(CCCCC2C(=C)OCC)C

DOS

IR

Vibrations