Geometry & MOs

Info

ID:

170875

PubChem CID:

75290335

Reduced:

N5O7C39H51 (1)

Stoich.:

A5B7C39D51 (1)

Weight, g/mol:

372.157288

ΔHf, kcal/mol:

-230.17

Dipole, Da:

8.68

IP(EA), eV:

 -9.01(-0.53)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4,5-dimethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaene-3,19-diol

Drug info:

PubChemData

Smile

CCCC(C(=O)C(=O)NC)NC(=O)C1CC2(CC(=NO2)C3=CC(=C(C(=C3)C)OC)C)CN1C(=O)C(C(C)(C)C)NC(=O)C4CC4C5=CC=CC=C5

DOS

IR

Vibrations