Geometry & MOs

Info

ID:	160084
PubChem CID:	57304675
Reduced:	ClH2O2C5F9 (1)
Stoich.:	AB2C2D5E9 (1)
Weight, g/mol:	206.057693
ΔH_f, kcal/mol:	-569.63
Dipole, Da:	1.38
IP(EA), eV:	-11.89(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-cyclohept-2-en-1-yl 2,2-difluoroethanethioate

Drug info:

PubChemData

Smile

C(C(OC(C(O)(F)F)(F)Cl)(F)F)(C(F)(F)F)F

DOS

IR

Vibrations