Geometry & MOs

Info

ID:	257586
PubChem CID:	103147243
Reduced:	BrSF2O2C10H11 (1)
Stoich.:	ABC2D2E10F11 (1)
Weight, g/mol:	248.041564
ΔH_f, kcal/mol:	-153.08
Dipole, Da:	4.43
IP(EA), eV:	-9.38(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propan-1-one

Drug info:

PubChemData

Smile

C1=C(SC(=C1)Br)CC(=O)CCOCC(F)F

DOS

IR

Vibrations