Geometry & MOs

Info

ID:	366274
PubChem CID:	127319731
Reduced:	O2N3C20H23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	388.156912
ΔH_f, kcal/mol:	-43.41
Dipole, Da:	9.28
IP(EA), eV:	-8.94(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=CC(=C2)C(=O)CCC(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations