Geometry & MOs

Info

ID:

417623

PubChem CID:

135102289

Reduced:

N6O6C35H44 (1)

Stoich.:

A6B6C35D44 (1)

Weight, g/mol:

383.19574

ΔHf, kcal/mol:

-189.51

Dipole, Da:

5.43

IP(EA), eV:

 -9.55(-0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-methyl-8-oxa-1,11,12,13,19-pentazatetracyclo[17.2.2.13,7.111,14]pentacosa-3(25),4,6,12,14(24)-pentaene-2,18-dione

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N[C@@H](C(=O)NCCCN(CCCC(=O)N[C@H](C(=O)N1)CC2=CC=CC=C2)C(=O)C3=C(ON=C3C4=CC=CC=C4)C)C(C)C

DOS

IR

Vibrations