Geometry & MOs

Info

ID:	271087
PubChem CID:	103643222
Reduced:	SO5C11H20 (1)
Stoich.:	AB5C11D20 (1)
Weight, g/mol:	285.097663
ΔH_f, kcal/mol:	-243.9
Dipole, Da:	3.22
IP(EA), eV:	-10.0(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-quinolin-6-yl-3-(2,2,2-trifluoroethoxy)propan-1-ol

Drug info:

PubChemData

Smile

CCCCOC(=O)CS(=O)(=O)CC1CCCO1

DOS

IR

Vibrations