Geometry & MOs

Info

ID:

337116

PubChem CID:

127256681

Reduced:

NO2H5C6 (1)

Stoich.:

AB2C5D6 (1)

Weight, g/mol:

123.032028

ΔHf, kcal/mol:

-31.0

Dipole, Da:

2.39

IP(EA), eV:

-10.1(-1.87)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

pyrrole-2,2-dicarbaldehyde

Drug info:

PubChemData

Smile

C\1=CC(=O)N/C1=C/C=O

DOS

IR

Vibrations