Geometry & MOs

Info

ID:	358668
PubChem CID:	127296458
Reduced:	O2N3C21H23 (1)
Stoich.:	A2B3C21D23 (1)
Weight, g/mol:	362.163043
ΔH_f, kcal/mol:	0.89
Dipole, Da:	4.6
IP(EA), eV:	-8.27(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-benzodioxol-5-yl)-1-[2-(1H-indol-2-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CC3=CC=CC=C3N2)C(=O)C4=NOC5=C4CCCC5

DOS

IR

Vibrations