Geometry & MOs

Info

ID:

314431

PubChem CID:

126621796

Reduced:

NO3H15C26 (1)

Stoich.:

AB3C15D26 (1)

Weight, g/mol:

337.092521

ΔHf, kcal/mol:

75.91

Dipole, Da:

5.18

IP(EA), eV:

 -8.74(-1.36)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

18-methyl-9-thia-22-azahexacyclo[11.11.0.02,10.03,8.015,23.016,21]tetracosa-1(24),2(10),3,5,7,11,13,15(23),16(21),17,19-undecaene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC(=C2C3=CC4=C(C=C3)C5=C(C=C4)OC6=CC=CC=C65)[N+](=O)[O-]

DOS

IR

Vibrations