Geometry & MOs

Info

ID:	340257
PubChem CID:	127262268
Reduced:	O3F6C14H14 (1)
Stoich.:	A3B6C14D14 (1)
Weight, g/mol:	192.078644
ΔH_f, kcal/mol:	-435.63
Dipole, Da:	5.05
IP(EA), eV:	-10.17(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclooctatetraenyl ethyl carbonate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)OC(C1=CC=CC=C1)(C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations