Geometry & MOs

Info

ID:	361703
PubChem CID:	127304418
Reduced:	ON3C10H16 (2)
Stoich.:	AB3C10D16 (2)
Weight, g/mol:	387.146203
ΔH_f, kcal/mol:	-25.19
Dipole, Da:	2.18
IP(EA), eV:	-8.9(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-chloroindol-1-yl)-1-[4-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CC(C)C)C)CC(=O)N2CCN(CC2)C(C)C3=NC(=NO3)C

DOS

IR

Vibrations