Geometry & MOs

Info

ID:	355753
PubChem CID:	127290605
Reduced:	SN2O3C20H24 (1)
Stoich.:	AB2C3D20E24 (1)
Weight, g/mol:	387.150429
ΔH_f, kcal/mol:	-80.19
Dipole, Da:	7.44
IP(EA), eV:	-8.85(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)sulfonyl]-4-phenylmethoxypiperidine

Drug info:

PubChemData

Smile

CC1CC2=C(O1)C=CC(=C2)S(=O)(=O)NC3CCN(C3)CC4=CC=CC=C4

DOS

IR

Vibrations