Geometry & MOs

Info

ID:	130578
PubChem CID:	51091345
Reduced:	SN2O6C12H16 (1)
Stoich.:	AB2C6D12E16 (1)
Weight, g/mol:	320.152478
ΔH_f, kcal/mol:	-221.54
Dipole, Da:	4.58
IP(EA), eV:	-9.69(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-indol-2-yl-(4-phenoxypiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

COC(=O)C1CCN(CC1)S(=O)(=O)NC(=O)C2=COC=C2

DOS

IR

Vibrations