Geometry & MOs

Info

ID:

146496

PubChem CID:

53698060

Reduced:

NOC9H19 (1)

Stoich.:

ABC9D19 (1)

Weight, g/mol:

201.019271

ΔHf, kcal/mol:

-64.96

Dipole, Da:

3.0

IP(EA), eV:

-8.48(2.26)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-chloro-1,5-dimethyl-4,6-dioxopyridine-3-carbaldehyde

Drug info:

PubChemData

Smile

CCOC(C)C1CCNCC1

DOS

IR

Vibrations