Geometry & MOs

Info

ID:

219549

PubChem CID:

85149170

Reduced:

O3N6C33H44 (1)

Stoich.:

A3B6C33D44 (1)

Weight, g/mol:

566.360739

ΔHf, kcal/mol:

-87.54

Dipole, Da:

3.2

IP(EA), eV:

 -8.2(-0.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6'-but-2-en-2-yl-10-ethyl-9-hydroxy-5',6,14,16-tetramethylspiro[2,20-dioxatricyclo[17.3.1.04,9]tricosa-5,10,12,16-tetraene-21,2'-oxane]-3,7-dione

Drug info:

PubChemData

Smile

CC1CC(C2C(N1)N(C(=O)N(C2=O)C3=CC=CC=C3)CCCCN4CCN(CC4)C5=CC=CC=C5)C(=O)N6CCCC6

DOS

IR

Vibrations