Geometry & MOs

Info

ID:

326041

PubChem CID:

126686177

Reduced:

NO3C13H27 (2)

Stoich.:

AB3C13D27 (2)

Weight, g/mol:

385.127385

ΔHf, kcal/mol:

-383.21

Dipole, Da:

6.78

IP(EA), eV:

 -9.78(0.23)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[6-hydroxy-14-methyl-15-(methylaminomethyl)-4-oxo-10-oxa-3,14-diazatetracyclo[9.7.0.02,7.013,17]octadeca-1(11),2(7),5,12,15,17-hexaen-5-yl] hydrogen carbonate

Drug info:

PubChemData

Smile

CCCC(C(CCC)(CCC)[NH3+])O.CCCC(C(CCC)(CCC)[NH3+])O.C(=C\C(=O)[O-])\C(=O)[O-]

DOS

IR

Vibrations