Geometry & MOs

Info

ID:

328691

PubChem CID:

126726575

Reduced:

O3C15H22 (1)

Stoich.:

A3B15C22 (1)

Weight, g/mol:

218.167065

ΔHf, kcal/mol:

-82.85

Dipole, Da:

0.85

IP(EA), eV:

-9.67(0.75)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-ethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carbaldehyde

Drug info:

PubChemData

Smile

COC1CC2CC1C3C2C4CC3C(C4)C(=O)OC

DOS

IR

Vibrations