Geometry & MOs

Info

ID:	399658
PubChem CID:	135041561
Reduced:	OSiC15H28 (1)
Stoich.:	ABC15D28 (1)
Weight, g/mol:	214.084124
ΔH_f, kcal/mol:	-86.79
Dipole, Da:	1.83
IP(EA), eV:	-9.2(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (1S,4R)-7-oxabicyclo[2.2.1]heptane-2,2-dicarboxylate

Drug info:

PubChemData

Smile

CCC[C@H]1C/C(=C\[Si](C)(C)C)/C[C@H](O1)/C=C/C

DOS

IR

Vibrations