Geometry & MOs

Info

ID:	136932
PubChem CID:	52123709
Reduced:	FO4N5C25H34 (1)
Stoich.:	AB4C5D25E34 (1)
Weight, g/mol:	420.196154
ΔH_f, kcal/mol:	-185.89
Dipole, Da:	6.82
IP(EA), eV:	-9.2(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-2,3-dihydro-1H-inden-1-yl]-1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C2CCN(CC2)CC3=NN=C(O3)C4=CC=C(C=C4)F

DOS

IR

Vibrations