Geometry & MOs

Info

ID:

146064

PubChem CID:

53629711

Reduced:

NO2C5H8 (1)

Stoich.:

AB2C5D8 (1)

Weight, g/mol:

116.071154

ΔHf, kcal/mol:

-8.67

Dipole, Da:

6.05

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.745481

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[CH2]CN(C[CH2+])C(=O)[O-]

DOS

IR

Vibrations