Geometry & MOs

Info

ID:	407862
PubChem CID:	135080617
Reduced:	OF2C10H10 (1)
Stoich.:	AB2C10D10 (1)
Weight, g/mol:	219.046234
ΔH_f, kcal/mol:	-109.97
Dipole, Da:	1.79
IP(EA), eV:	-9.8(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (1S,2S)-2-(chloromethyl)-1-cyano-2-fluorocyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

C=C(C1=CC=C(C=C1)F)[C@@H](CO)F

DOS

IR

Vibrations