Geometry & MOs

Info

ID:	366272
PubChem CID:	127319729
Reduced:	SO4N5C17H19 (1)
Stoich.:	AB4C5D17E19 (1)
Weight, g/mol:	388.156912
ΔH_f, kcal/mol:	-88.79
Dipole, Da:	6.19
IP(EA), eV:	-9.59(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methanone

Drug info:

PubChemData

Smile

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations