Geometry & MOs

Info

ID:	142603
PubChem CID:	53064806
Reduced:	SN3O6C22H25 (1)
Stoich.:	AB3C6D22E25 (1)
Weight, g/mol:	429.18009
ΔH_f, kcal/mol:	-195.29
Dipole, Da:	6.98
IP(EA), eV:	-9.19(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-6-[5-(5-oxo-1-phenylpyrrolidin-3-yl)-1,2,4-oxadiazol-3-yl]-1-propylquinoxalin-2-one

Drug info:

PubChemData

Smile

CC1C(=O)NC2=C(O1)C=C(C(=C2)C)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)OC

DOS

IR

Vibrations