Geometry & MOs

Info

ID:

256860

PubChem CID:

103141918

Reduced:

O2S2N3C14H15 (1)

Stoich.:

A2B2C3D14E15 (1)

Weight, g/mol:

294.194343

ΔHf, kcal/mol:

36.85

Dipole, Da:

9.79

IP(EA), eV:

-9.04(-1.35)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CSC(CS1)CNC2=C3C=NC=CC3=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations