Geometry & MOs

Info

ID:	155246
PubChem CID:	56323503
Reduced:	SO3N5C19H19 (1)
Stoich.:	AB3C5D19E19 (1)
Weight, g/mol:	450.165168
ΔH_f, kcal/mol:	24.5
Dipole, Da:	6.62
IP(EA), eV:	-9.31(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3'-[2-[4-(5-nitropyridin-2-yl)piperazin-1-yl]-2-oxoethyl]spiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione

Drug info:

PubChemData

Smile

C1CN(CCN1C2=NC=C(C=C2)[N+](=O)[O-])C(=O)CCC3=NC4=CC=CC=C4S3

DOS

IR

Vibrations