Geometry & MOs

Info

ID:	257681
PubChem CID:	103147917
Reduced:	FOC6H11 (2)
Stoich.:	ABC6D11 (2)
Weight, g/mol:	314.094135
ΔH_f, kcal/mol:	-231.46
Dipole, Da:	4.45
IP(EA), eV:	-10.17(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,2-difluoroethoxy)-1-[4-(trifluoromethoxy)phenyl]butan-2-ol

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(CCOCC(F)F)O

DOS

IR

Vibrations