Geometry & MOs

Info

ID:

219579

PubChem CID:

85149306

Reduced:

NO2H18C19 (2)

Stoich.:

AB2C18D19 (2)

Weight, g/mol:

584.325023

ΔHf, kcal/mol:

14.38

Dipole, Da:

4.28

IP(EA), eV:

 -9.07(-0.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2,23-dioxa-11,29-diazaheptacyclo[27.11.0.01,36.03,11.03,36.04,9.030,35]tetraconta-4,6,8,30,32,34-hexaene-10,24,28-trione

Drug info:

PubChemData

Smile

CC(=CC1=CC=CC=C1)C2C(C(=O)N2N3C(C(C3=O)OCC4=CC=CC=C4)C(=CC5=CC=CC=C5)C)OCC6=CC=CC=C6

DOS

IR

Vibrations