Geometry & MOs

Info

ID:	53893
PubChem CID:	14718310
Reduced:	F7O8C16H19 (1)
Stoich.:	A7B8C16D19 (1)
Weight, g/mol:	442.122636
ΔH_f, kcal/mol:	-716.08
Dipole, Da:	1.97
IP(EA), eV:	-11.07(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dibutyl 2-(2,2,3,3,4,4,4-heptafluorobutanoyloxy)butanedioate

Drug info:

PubChemData

Smile

CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)OC(=O)C(C(C(F)(F)F)(F)F)(F)F

DOS

IR

Vibrations