Geometry & MOs

Info

ID:

127606

PubChem CID:

51008359

Reduced:

O3C12H16 (2)

Stoich.:

A3B12C16 (2)

Weight, g/mol:

330.157957

ΔHf, kcal/mol:

-285.36

Dipole, Da:

3.78

IP(EA), eV:

 -9.9(0.46)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1S,10S)-4-methoxy-10,13,15-trimethyl-8,11-dioxa-13,15-diazatetracyclo[8.7.1.02,7.012,17]octadeca-2(7),3,5,12(17)-tetraen-16-one

Drug info:

PubChemData

Smile

CC[C@]12CC[C@@H]3[C@@]45CC[C@@H]([C@]([C@@H]4[C@H]([C@@]3(C1)CC2=C)C(=O)OC)(C(=O)O5)C)OC(=O)C

DOS

IR

Vibrations