Geometry & MOs

Info

ID:	272156
PubChem CID:	103729219
Reduced:	SO2N3C16H23 (1)
Stoich.:	AB2C3D16E23 (1)
Weight, g/mol:	302.04523
ΔH_f, kcal/mol:	-61.86
Dipole, Da:	6.92
IP(EA), eV:	-9.48(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-bromothiophen-2-yl)ethyl]-1-methylpiperidin-4-amine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC1CNCC2=CC=C(S2)C#N

DOS

IR

Vibrations