Geometry & MOs

Info

ID:

326389

PubChem CID:

126687454

Reduced:

NOC8H10 (1)

Stoich.:

ABC8D10 (1)

Weight, g/mol:

149.084064

ΔHf, kcal/mol:

14.82

Dipole, Da:

3.57

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.169759

Charge, e:

 0

Chem-info

IUPAC name:

1-[(1Z)-buta-1,3-dienyl]-2-nitrosocyclopentene

Drug info:

PubChemData

Smile

C1CC2=C(C1)N(CC=C2)[O-]

DOS

IR

Vibrations