Geometry & MOs

Info

ID:

340374

PubChem CID:

127262385

Reduced:

O3C11H18 (1)

Stoich.:

A3B11C18 (1)

Weight, g/mol:

246.136828

ΔHf, kcal/mol:

-152.15

Dipole, Da:

4.07

IP(EA), eV:

-9.93(0.19)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(4-carbamimidoylphenyl) cyclohexanecarboxylate

Drug info:

PubChemData

Smile

CC(C)(C=O)OC(=O)C1CCCCC1

DOS

IR

Vibrations