Geometry & MOs

Info

ID:

320835

PubChem CID:

126663812

Reduced:

SN2O4C8H18 (1)

Stoich.:

AB2C4D8E18 (1)

Weight, g/mol:

678.30535

ΔHf, kcal/mol:

-182.62

Dipole, Da:

4.39

IP(EA), eV:

 -9.85(-0.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3S,4S,11S)-4,19-bis(dimethylamino)-11,14-dihydroxy-18-(methylaminomethyl)-8,16-bis(phenylmethoxy)-6-oxa-7-azapentacyclo[11.8.0.03,11.05,9.015,20]henicosa-5(9),7,13,15,17,19-hexaene-10,12-dione

Drug info:

PubChemData

Smile

CC(C)C(C(=O)C(CCN)S(=O)(=O)O)N

DOS

IR

Vibrations