Geometry & MOs

Info

ID:	48152
PubChem CID:	10537525
Reduced:	OH4C8 (2)
Stoich.:	AB4C8 (2)
Weight, g/mol:	232.131074
ΔH_f, kcal/mol:	32.44
Dipole, Da:	5.33
IP(EA), eV:	-9.27(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R,3R,4S,6R)-2,3-bis(methoxymethoxy)-4-methyl-7-oxabicyclo[4.1.0]heptane

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C2C4=C(C=C3)C(=O)C4=O

DOS

IR

Vibrations