Geometry & MOs

Info

ID:

232862

PubChem CID:

87577278

Reduced:

N2O3C16H20 (2)

Stoich.:

A2B3C16D20 (2)

Weight, g/mol:

1066.324114

ΔHf, kcal/mol:

-190.45

Dipole, Da:

10.68

IP(EA), eV:

 -9.22(-0.22)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[2-[(Z)-[5-(benzenesulfonamido)-2-oxo-1H-indol-3-ylidene]methyl]-6,6-dimethyl-4-oxo-5,7-dihydro-1H-indol-3-yl]propanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)[C@@H](C(=O)N[C@@H](CCC(CC1=CC=C(C=C1)C2=CC=NC=C2)N(C(=O)O)O)CC3=CC=CC=C3)NC(=O)OC

DOS

IR

Vibrations