Geometry & MOs

Info

ID:

237728

PubChem CID:

92721104

Reduced:

ClO3N4H21C26 (1)

Stoich.:

AB3C4D21E26 (1)

Weight, g/mol:

364.099397

ΔHf, kcal/mol:

-29.32

Dipole, Da:

7.6

IP(EA), eV:

 -8.5(-0.92)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(9S)-12,14-dimethyl-9-thiophen-2-yl-1,8,12,14-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-2,4,6,10,16-pentaene-13,15-dione

Drug info:

PubChemData

Smile

CC1=CC=C(O1)[C@@H]2C3=C4C(=C(N3C5=CC=CC=C5N2)C6=CC=C(C=C6)Cl)C(=O)N(C(=O)N4C)C

DOS

IR

Vibrations