Geometry & MOs

Info

ID:

372550

PubChem CID:

131299578

Reduced:

NO4H7C10 (1)

Stoich.:

AB4C7D10 (1)

Weight, g/mol:

205.073893

ΔHf, kcal/mol:

-84.79

Dipole, Da:

5.9

IP(EA), eV:

-9.26(-1.37)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-hydroxy-3-methoxy-4,5-dimethylbenzoyl cyanide

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=C(C(=C2)O)C(=O)C#N

DOS

IR

Vibrations