Geometry & MOs

Info

ID:	67603
PubChem CID:	46506799
Reduced:	SN3O3C22H27 (1)
Stoich.:	AB3C3D22E27 (1)
Weight, g/mol:	232.048407
ΔH_f, kcal/mol:	-83.28
Dipole, Da:	7.87
IP(EA), eV:	-7.95(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-benzodioxol-5-yl)-1H-pyrazine-2,3-dione

Drug info:

PubChemData

Smile

CC1CN(CCN1C2=CC=C(C=C2)C)C(=O)C3=CC(=CC=C3)N4CCCS4(=O)=O

DOS

IR

Vibrations