Geometry & MOs

Info

ID:	145803
PubChem CID:	53595800
Reduced:	ON4C17H20 (1)
Stoich.:	AB4C17D20 (1)
Weight, g/mol:	342.241962
ΔH_f, kcal/mol:	25.18
Dipole, Da:	5.22
IP(EA), eV:	-9.28(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[butyl(methyl)amino]methyl]-N-(1H-indol-4-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=CC=CC(=C1)CN2CCC3=CN=CN=C3C2

DOS

IR

Vibrations