Geometry & MOs

Info

ID:	143303
PubChem CID:	53183908
Reduced:	ClO3N4H15C20 (1)
Stoich.:	AB3C4D15E20 (1)
Weight, g/mol:	395.122752
ΔH_f, kcal/mol:	0.14
Dipole, Da:	8.53
IP(EA), eV:	-9.05(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[4-(3,5-difluorophenyl)sulfonylpiperazin-1-yl]-2-methyl-2,3-dihydroimidazo[1,2-a]pyrazine

Drug info:

PubChemData

Smile

C1CN(CC2=C1C(=O)N3C(=N2)C=C(N3)C4=CC=CC=C4Cl)C(=O)C5=CC=CO5

DOS

IR

Vibrations