Geometry & MOs

Info

ID:	352868
PubChem CID:	127283958
Reduced:	SN2O3C11H20 (1)
Stoich.:	AB2C3D11E20 (1)
Weight, g/mol:	387.190654
ΔH_f, kcal/mol:	-147.32
Dipole, Da:	4.08
IP(EA), eV:	-9.37(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-1,3-dioxo-5,6,8,8a-tetrahydroimidazo[1,5-a]pyrazine-7-carboxamide

Drug info:

PubChemData

Smile

CN1CC(CC1=O)NS(=O)(=O)C2CCCCC2

DOS

IR

Vibrations