Geometry & MOs

Info

ID:

85678

PubChem CID:

49878021

Reduced:

FN2O5H23C25 (1)

Stoich.:

AB2C5D23E25 (1)

Weight, g/mol:

531.236936

ΔHf, kcal/mol:

-160.24

Dipole, Da:

8.5

IP(EA), eV:

 -9.01(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4'Z)-4'-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1'-(2-morpholin-4-ylethyl)-1-propylspiro[indole-3,5'-pyrrolidine]-2,2',3'-trione

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)/C(=C\2/C(=O)C(=O)N(C23C4=CC=CC=C4N(C3=O)CC=C)CCOC)/O)F

DOS

IR

Vibrations