Geometry & MOs

Info

ID:

168604

PubChem CID:

74994140

Reduced:

O2N3C6H11 (1)

Stoich.:

A2B3C6D11 (1)

Weight, g/mol:

1978.999528

ΔHf, kcal/mol:

-97.88

Dipole, Da:

4.94

IP(EA), eV:

-10.39(-0.01)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC1C(NC(=O)NC1=O)N

DOS

IR

Vibrations