Geometry & MOs

Info

ID:	124219
PubChem CID:	50875267
Reduced:	ClSN3O3C16H24 (1)
Stoich.:	ABC3D3E16F24 (1)
Weight, g/mol:	384.187149
ΔH_f, kcal/mol:	-128.94
Dipole, Da:	5.61
IP(EA), eV:	-8.54(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzylsulfanyl-N-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCN(CC1)C)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

DOS

IR

Vibrations