Geometry & MOs

Info

ID:	403837
PubChem CID:	135062079
Reduced:	FNC17H18 (1)
Stoich.:	ABC17D18 (1)
Weight, g/mol:	334.04622
ΔH_f, kcal/mol:	-10.86
Dipole, Da:	1.96
IP(EA), eV:	-9.21(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1S,2R)-2-fluoro-2-[4-(pentafluoro-lambda6-sulfanyl)phenyl]cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2[C@H]([C@H](N1)CCC3=CC=CC=C3)F

DOS

IR

Vibrations