Geometry & MOs

Info

ID:

231842

PubChem CID:

87574757

Reduced:

N3C7H14 (1)

Stoich.:

A3B7C14 (1)

Weight, g/mol:

297.152211

ΔHf, kcal/mol:

27.68

Dipole, Da:

1.69

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.766076

Charge, e:

0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCN1C=C[N+](=C1N)C

DOS

IR

Vibrations