Geometry & MOs

Info

ID:	257632
PubChem CID:	103147486
Reduced:	O2F6C9H14 (1)
Stoich.:	A2B6C9D14 (1)
Weight, g/mol:	300.05402
ΔH_f, kcal/mol:	-444.16
Dipole, Da:	0.65
IP(EA), eV:	-10.83(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-2-fluorophenyl)-4-(2,2,2-trifluoroethoxy)butan-2-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations