Geometry & MOs

Info

ID:

335134

PubChem CID:

127253995

Reduced:

O2N6C19H24 (1)

Stoich.:

A2B6C19D24 (1)

Weight, g/mol:

525.130278

ΔHf, kcal/mol:

17.59

Dipole, Da:

10.0

IP(EA), eV:

 -8.4(-0.37)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2S,5'R)-7-chloro-4,6-dimethoxy-5'-methyl-3'-[4-(2-oxoimidazolidine-1-carbonyl)anilino]spiro[1-benzofuran-2,6'-cyclohex-2-ene]-1',3-dione

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H](C(=O)N1CCC2=C(C1)C3=C(N2)C=CC(=C3)OC)N4C=NN=N4

DOS

IR

Vibrations