Geometry & MOs

Info

ID:

57028

PubChem CID:

22395237

Reduced:

SO2N3C5H5 (1)

Stoich.:

AB2C3D5E5 (1)

Weight, g/mol:

204.969734

ΔHf, kcal/mol:

15.64

Dipole, Da:

3.43

IP(EA), eV:

-9.13(-0.9)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(3,5-dichloro-4-oxopyridin-1-yl)acetaldehyde

Drug info:

PubChemData

Smile

C1=C(N=C(S1)N)/C(=N/O)/C=O

DOS

IR

Vibrations