Geometry & MOs

Info

ID:	256833
PubChem CID:	103141709
Reduced:	IN3H14C16 (1)
Stoich.:	AB3C14D16 (1)
Weight, g/mol:	268.178693
ΔH_f, kcal/mol:	111.62
Dipole, Da:	2.27
IP(EA), eV:	-9.23(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations