Geometry & MOs

Info

ID:	257613
PubChem CID:	103147357
Reduced:	F3O3C10H19 (1)
Stoich.:	A3B3C10D19 (1)
Weight, g/mol:	299.113313
ΔH_f, kcal/mol:	-316.52
Dipole, Da:	4.04
IP(EA), eV:	-9.47(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(CCOC)C(CCOCC(F)(F)F)O

DOS

IR

Vibrations