Geometry & MOs

Info

ID:

168863

PubChem CID:

75029114

Reduced:

N3O4C17H17 (1)

Stoich.:

A3B4C17D17 (1)

Weight, g/mol:

509.187005

ΔHf, kcal/mol:

-104.31

Dipole, Da:

4.27

IP(EA), eV:

-9.36(-1.5)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCOC(=O)C1C=NC2=C(C1=O)C=C(C=C2)C3=NNC(=O)CC3C

DOS

IR

Vibrations