Geometry & MOs

Info

ID:

219763

PubChem CID:

85164870

Reduced:

ClS2O3N5H28C29 (1)

Stoich.:

AB2C3D5E28F29 (1)

Weight, g/mol:

594.225368

ΔHf, kcal/mol:

5.24

Dipole, Da:

5.89

IP(EA), eV:

 -8.6(-0.91)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(9,17,19-trimethoxy-18-methyl-5,13-diphenyl-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2,8,10,15,17,19-hexaen-21-yl) acetate

Drug info:

PubChemData

Smile

CN(CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N)Cl)C(=NSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N

DOS

IR

Vibrations