Geometry & MOs

Info

ID:	256849
PubChem CID:	103141842
Reduced:	SO2N3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	296.209993
ΔH_f, kcal/mol:	24.09
Dipole, Da:	11.11
IP(EA), eV:	-8.98(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butan-2-yl-6-ethyl-1-[(5-methyloxolan-2-yl)methyl]piperazine-2,5-dione

Drug info:

PubChemData

Smile

C1CCSC(C1)CNC2=C3C=NC=CC3=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations