Geometry & MOs

Info

ID:	257635
PubChem CID:	103147502
Reduced:	BrSO2F3C9H10 (1)
Stoich.:	ABC2D3E9F10 (1)
Weight, g/mol:	278.112979
ΔH_f, kcal/mol:	-225.12
Dipole, Da:	4.21
IP(EA), eV:	-9.34(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethoxyphenyl)-3-(2,2,2-trifluoroethoxy)propan-1-ol

Drug info:

PubChemData

Smile

C1=C(C(=CS1)Br)C(CCOCC(F)(F)F)O

DOS

IR

Vibrations