Geometry & MOs

Info

ID:

187816

PubChem CID:

77629436

Reduced:

N2Cl5C34H35 (1)

Stoich.:

A2B5C34D35 (1)

Weight, g/mol:

486.179087

ΔHf, kcal/mol:

-1.23

Dipole, Da:

5.33

IP(EA), eV:

 -9.48(-0.54)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[1-(2-carbamoyl-1H-indol-3-yl)-3-hydroxypropan-2-yl]-5-(3-methoxyphenyl)-2,3-dihydro-1-benzofuran-7-carboxylic acid

Drug info:

PubChemData

Smile

CNC1CCC(C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl.CNC1CCC(C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl.Cl

DOS

IR

Vibrations