Geometry & MOs

Info

ID:

392937

PubChem CID:

135018577

Reduced:

N2O8H22C23 (1)

Stoich.:

A2B8C22D23 (1)

Weight, g/mol:

593.268303

ΔHf, kcal/mol:

-138.53

Dipole, Da:

2.07

IP(EA), eV:

 -9.31(-2.19)

Spin(Sz, S2):

 None, None

Charge, e:

 1

Chem-info

IUPAC name:

20-hydroxy-15-(methoxymethoxy)-5,7,7-trimethyl-13-oxo-3-tri(propan-2-yl)silyloxy-6,8-dioxapentacyclo[10.8.0.02,10.05,9.014,19]icosa-1(20),2(10),3,11,14(19),15,17-heptaene-11-diazonium

Drug info:

PubChemData

Smile

CC1(OC2C3=C([C@H]([C@@H](C2(O1)C)O)O)C4=C(C3=[N+]=[N-])C(=O)C5=C(C4=O)C=CC=C5OCOC)C

DOS

IR

Vibrations