Geometry & MOs

Info

ID:

7269

PubChem CID:

71810

Reduced:

NO2C20H38 (1)

Stoich.:

AB2C20D38 (1)

Weight, g/mol:

324.290254

ΔHf, kcal/mol:

-117.18

Dipole, Da:

1.71

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.752038

Charge, e:

 1

Chem-info

IUPAC name:

2-(2,2-dicyclopentylacetyl)oxyethyl-triethylazanium

Drug info:

PubChemData

Smile

CC[N+](CC)(CC)CCOC(=O)C(C1CCCC1)C2CCCC2

DOS

IR

Vibrations