Geometry & MOs

Info

ID:

183373

PubChem CID:

77012987

Reduced:

N2O5H10C12 (1)

Stoich.:

A2B5C10D12 (1)

Weight, g/mol:

270.067428

ΔHf, kcal/mol:

-96.19

Dipole, Da:

6.3

IP(EA), eV:

-9.84(-2.02)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-6-oxo-3H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC2C(=CC(=NC2=O)C(=O)NOCC(=O)O)C=C1

DOS

IR

Vibrations