Geometry & MOs

Info

ID:

355921

PubChem CID:

127290773

Reduced:

N2O3C19H30 (1)

Stoich.:

A2B3C19D30 (1)

Weight, g/mol:

293.083413

ΔHf, kcal/mol:

-181.77

Dipole, Da:

2.72

IP(EA), eV:

-9.6(0.58)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-cyano-6-methylsulfanyl-N-(oxan-3-yl)-2-oxo-1H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(COC1)NC(=O)CNC(=O)CC23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations