Geometry & MOs

Info

ID:

403356

PubChem CID:

135059853

Reduced:

IOC5H8 (1)

Stoich.:

ABC5D8 (1)

Weight, g/mol:

201.9501

ΔHf, kcal/mol:

-30.26

Dipole, Da:

3.63

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.795744

Charge, e:

 -1

Chem-info

IUPAC name:

oxolan-3-ylmethanone;rhodium

Drug info:

PubChemData

Smile

C1CC2C([I+]2)OC1

DOS

IR

Vibrations