Geometry & MOs

Info

ID:	256837
PubChem CID:	103141741
Reduced:	OSN3C15H15 (1)
Stoich.:	ABC3D15E15 (1)
Weight, g/mol:	296.209993
ΔH_f, kcal/mol:	62.71
Dipole, Da:	3.48
IP(EA), eV:	-8.68(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CSC(=C1)C(C2=CC=CC3=C2C=NC=C3)NN

DOS

IR

Vibrations