Geometry & MOs

Info

ID:	270362
PubChem CID:	103636253
Reduced:	OF2C6H7 (2)
Stoich.:	AB2C6D7 (2)
Weight, g/mol:	278.112979
ΔH_f, kcal/mol:	-291.02
Dipole, Da:	5.58
IP(EA), eV:	-9.53(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxyphenyl)-4-(2,2,2-trifluoroethoxy)butan-2-ol

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)CC(CCOCC(F)(F)F)O

DOS

IR

Vibrations