Geometry & MOs

Info

ID:	352990
PubChem CID:	127284111
Reduced:	SN3O3C18H33 (1)
Stoich.:	AB3C3D18E33 (1)
Weight, g/mol:	348.150764
ΔH_f, kcal/mol:	-153.83
Dipole, Da:	4.7
IP(EA), eV:	-8.99(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1H-inden-1-yl-[4-(1,1-dioxothiolan-3-yl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N1CCN(CC1)C2CCS(=O)(=O)C2)N3CCCCC3

DOS

IR

Vibrations