Geometry & MOs

Info

ID:	368132
PubChem CID:	127327669
Reduced:	SN3O3C17H25 (1)
Stoich.:	AB3C3D17E25 (1)
Weight, g/mol:	378.099791
ΔH_f, kcal/mol:	-115.42
Dipole, Da:	6.79
IP(EA), eV:	-8.63(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-7-[(1-oxo-3,4-dihydro-2H-isoquinolin-7-yl)sulfonyl]-1,3,7-triazaspiro[4.4]nonane-2,4-dione

Drug info:

PubChemData

Smile

CCN1CCCC(C1)CNS(=O)(=O)C2=CC3=C(CCNC3=O)C=C2

DOS

IR

Vibrations