Geometry & MOs

Info

ID:	257642
PubChem CID:	103147572
Reduced:	O2F3C9H13 (1)
Stoich.:	A2B3C9D13 (1)
Weight, g/mol:	288.019863
ΔH_f, kcal/mol:	-231.08
Dipole, Da:	5.89
IP(EA), eV:	-10.07(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chlorothiophen-2-yl)-4-(2,2,2-trifluoroethoxy)butan-2-ol

Drug info:

PubChemData

Smile

CC#CCC(CCOCC(F)(F)F)O

DOS

IR

Vibrations