Geometry & MOs

Info

ID:	351353
PubChem CID:	127280241
Reduced:	ClON2C9H9 (2)
Stoich.:	ABC2D9E9 (2)
Weight, g/mol:	392.080681
ΔH_f, kcal/mol:	-12.39
Dipole, Da:	4.46
IP(EA), eV:	-8.76(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dichloro-1H-indol-2-yl)-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)C3=CC4=C(N3)C=CC(=C4Cl)Cl

DOS

IR

Vibrations