Geometry & MOs

Info

ID:

325473

PubChem CID:

126683449

Reduced:

N2O5C36H52 (1)

Stoich.:

A2B5C36D52 (1)

Weight, g/mol:

484.391646

ΔHf, kcal/mol:

-178.86

Dipole, Da:

11.44

IP(EA), eV:

 -9.43(-1.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1R,2S,5R,10S,20S)-20-(2-hydroxyethyl)-1,2,6,6,10,17,17,20-octamethyltetracyclo[12.8.0.02,11.05,10]docos-11-ene-7,13-dione

Drug info:

PubChemData

Smile

CC(=O)/C=C/1\[C@](CC[C@@H]2[C@@]1(C=C(C(=O)C2(C)C)C#N)C)(C)[C@@]3(CC[C@]4(CCC(CC4C3)(C)C)CCC(=O)NCC(=O)O)C

DOS

IR

Vibrations