Geometry & MOs

Info

ID:	403509
PubChem CID:	135060618
Reduced:	NO3C7H13 (1)
Stoich.:	AB3C7D13 (1)
Weight, g/mol:	327.93041
ΔH_f, kcal/mol:	-94.73
Dipole, Da:	3.53
IP(EA), eV:	-9.27(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dichloro-3,3,4,4,5,5,6,6-octafluorocyclohexane-1,1-diol

Drug info:

PubChemData

Smile

CC(C)/C=[N+](/CC(=O)OC)\[O-]

DOS

IR

Vibrations