Geometry & MOs

Info

ID:

194110

PubChem CID:

78484176

Reduced:

N3O5C18H27 (1)

Stoich.:

A3B5C18D27 (1)

Weight, g/mol:

301.191603

ΔHf, kcal/mol:

-113.14

Dipole, Da:

27.19

IP(EA), eV:

-7.4(-0.5)

Spin(Sz, S2):

None, None

Charge, e:

1

Chem-info

IUPAC name:

3-piperidin-1-ium-1-yl-1-(4-propan-2-ylphenyl)pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1CCC[NH+](C1)CC2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]

DOS

IR

Vibrations