Geometry & MOs

Info

ID:

326003

PubChem CID:

126685986

Reduced:

N3O5C24H29 (1)

Stoich.:

A3B5C24D29 (1)

Weight, g/mol:

495.273321

ΔHf, kcal/mol:

-185.15

Dipole, Da:

8.16

IP(EA), eV:

 -8.62(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[6-hydroxy-14-methyl-15-[(nonylamino)methyl]-4-oxo-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

CC1CCC2=C(C3=C1C=C4C(=C3)C=C(N4C)CNC(C)(C)C)NC(=O)C(=C2O)OC(=O)O

DOS

IR

Vibrations