Geometry & MOs

Info

ID:	360985
PubChem CID:	127301816
Reduced:	SO3N4C14H18 (1)
Stoich.:	AB3C4D14E18 (1)
Weight, g/mol:	336.125612
ΔH_f, kcal/mol:	-89.6
Dipole, Da:	3.06
IP(EA), eV:	-9.12(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-oxo-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethyl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CC=CS2)C(=O)CN3CC(=O)NC3=O

DOS

IR

Vibrations