Geometry & MOs

Info

ID:

59372

PubChem CID:

24844228

Reduced:

NaN2O2H18C19 (1)

Stoich.:

AB2C2D18E19 (1)

Weight, g/mol:

353.090212

ΔHf, kcal/mol:

-58.14

Dipole, Da:

8.33

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.760854

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC(=C1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)C.[Na]

DOS

IR

Vibrations