Geometry & MOs

Info

ID:

426365

PubChem CID:

135143656

Reduced:

NOSH29C44 (1)

Stoich.:

ABCD29E44 (1)

Weight, g/mol:

664.1394

ΔHf, kcal/mol:

160.6

Dipole, Da:

1.59

IP(EA), eV:

 -8.1(-0.54)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(2,6-dioxopiperidin-3-yl)-3-[2-[3-[[[2-(2-iodopropoxy)-3-oxopropyl]amino]methyl]anilino]-2-oxoethoxy]-2-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(SC2=CC=CC=C12)/C(=C\C=C)/C3=C4C(=CC=C3)C5(C6=CC=CC=C6N7C8=CC=CC=C8C9=C7C5=CC=C9)C1=CC=CC=C1O4

DOS

IR

Vibrations