Geometry & MOs

Info

ID:

127932

PubChem CID:

51023511

Reduced:

NSiO5C37H55 (1)

Stoich.:

ABC5D37E55 (1)

Weight, g/mol:

293.126323

ΔHf, kcal/mol:

-259.91

Dipole, Da:

6.84

IP(EA), eV:

 -9.09(0.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2S)-1-ethoxy-1-oxopropan-2-yl] (1S,5S)-6-methyl-7-oxo-6-azabicyclo[3.2.2]nona-3,8-diene-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)N(C)[C@H](CC1=CC=CC=C1)[C@H](CC(=O)[C@@]2(C[C@@H]3CC[C@]2(C3(C)C)C)O[Si](C)(C)C)O)OCC4=CC=CC=C4

DOS

IR

Vibrations