Geometry & MOs

Info

ID:	126906
PubChem CID:	50983883
Reduced:	SN3O3C19H23 (1)
Stoich.:	AB3C3D19E23 (1)
Weight, g/mol:	282.176585
ΔH_f, kcal/mol:	-74.01
Dipole, Da:	5.5
IP(EA), eV:	-8.14(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[[methyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]piperidin-1-yl]ethanol

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)C2CC(=O)NCC3=C2SC(=N3)N4CCCC4

DOS

IR

Vibrations