Geometry & MOs

Info

ID:	257669
PubChem CID:	103147823
Reduced:	O2F3C12H15 (1)
Stoich.:	A2B3C12D15 (1)
Weight, g/mol:	256.127486
ΔH_f, kcal/mol:	-233.8
Dipole, Da:	0.98
IP(EA), eV:	-9.73(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-4-(2,2-difluoroethoxy)butan-2-ol

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(CCOCC(F)F)O

DOS

IR

Vibrations