Geometry & MOs

Info

ID:

221008

PubChem CID:

85248185

Reduced:

IOH7C9 (1)

Stoich.:

ABC7D9 (1)

Weight, g/mol:

261.109999

ΔHf, kcal/mol:

26.48

Dipole, Da:

3.48

IP(EA), eV:

-9.8(-1.52)

Spin(Sz, S2):

None, None

Charge, e:

1

Chem-info

IUPAC name:

(4-methoxycarbonylphenyl)-(1-methyltetrazolidin-5-ylidene)methanediazonium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=CC=O)I

DOS

IR

Vibrations