Geometry & MOs

Info

ID:

385336

PubChem CID:

134978805

Reduced:

OC15H22 (1)

Stoich.:

AB15C22 (1)

Weight, g/mol:

222.16198

ΔHf, kcal/mol:

-40.77

Dipole, Da:

3.25

IP(EA), eV:

-9.36(0.32)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

cyclohexyl 2-[(1R)-2-methylidenecyclopentyl]acetate

Drug info:

PubChemData

Smile

CCC(C)C(CCCC=O)C1=CC=CC=C1

DOS

IR

Vibrations