Geometry & MOs

Info

ID:	407452
PubChem CID:	135080168
Reduced:	OF3C11H11 (1)
Stoich.:	AB3C11D11 (1)
Weight, g/mol:	188.08373
ΔH_f, kcal/mol:	-180.92
Dipole, Da:	3.88
IP(EA), eV:	-10.24(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,5S,6R)-6-phenyl-3-oxabicyclo[3.1.0]hexane-1-carbaldehyde

Drug info:

PubChemData

Smile

C/C=C/C(C1=CC=C(C=C1)C(F)(F)F)O

DOS

IR

Vibrations