Geometry & MOs

Info

ID:	432883
PubChem CID:	135173020
Reduced:	ON9H25C29 (1)
Stoich.:	AB9C25D29 (1)
Weight, g/mol:	243.089543
ΔH_f, kcal/mol:	228.17
Dipole, Da:	4.92
IP(EA), eV:	-7.87(-2.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione

Drug info:

PubChemData

Smile

C/C(=C/N(C)C1=CN=CC2=N/C(=C\3/C4=CC(=NC=C4NN3)C5=CC(=CN=C5)OCC6=CC=CC=C6)/N=C12)/N=C

DOS

IR

Vibrations