Geometry & MOs

Info

ID:

19702

PubChem CID:

570746

Reduced:

N4O7C40H46 (1)

Stoich.:

A4B7C40D46 (1)

Weight, g/mol:

694.33665

ΔHf, kcal/mol:

-229.53

Dipole, Da:

7.9

IP(EA), eV:

 -8.75(-0.23)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6,10-diacetyl-23-benzoyl-17-(4-methoxyphenyl)-16-oxa-1,6,10,23-tetrazatetracyclo[9.8.6.212,15.014,18]heptacosa-12,14,26-triene-19,24-dione

Drug info:

PubChemData

Smile

CC(=O)N1CCCCN2CCCN(C(=O)CC(C3=CC4=C(C=C3)OC(C4C2=O)C5=CC=C(C=C5)OC)N(CCC1)C(=O)C)C(=O)C6=CC=CC=C6

DOS

IR

Vibrations