Geometry & MOs

Info

ID:

137107

PubChem CID:

52152692

Reduced:

N3O5C26H35 (1)

Stoich.:

A3B5C26D35 (1)

Weight, g/mol:

469.257671

ΔHf, kcal/mol:

-149.29

Dipole, Da:

11.64

IP(EA), eV:

 -7.52(0.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5R)-1-[2-(dimethylamino)ethyl]-4-[hydroxy-(2,4,5-trimethyl-1H-pyrrol-3-yl)methylidene]-5-(3-methoxy-4-propoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)[C@@H]2C(=C(C3=C(NC(=C3C)C)C)[O-])C(=O)C(=O)N2CC[NH+](C)C)OC

DOS

IR

Vibrations