Geometry & MOs

Info

ID:	353153
PubChem CID:	127284333
Reduced:	N4O5C17H18 (1)
Stoich.:	A4B5C17D18 (1)
Weight, g/mol:	326.174276
ΔH_f, kcal/mol:	-175.25
Dipole, Da:	1.93
IP(EA), eV:	-9.2(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1H-inden-1-yl-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1C(=O)NC2=CC=CC(=C2O1)C(=O)N3CCC4(C3)C(=O)N(C(=O)N4)C

DOS

IR

Vibrations