Geometry & MOs

Info

ID:	347679
PubChem CID:	127272545
Reduced:	ON5C21H27 (1)
Stoich.:	AB5C21D27 (1)
Weight, g/mol:	392.221226
ΔH_f, kcal/mol:	17.23
Dipole, Da:	5.87
IP(EA), eV:	-9.09(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1(CC2CC(C1)(CN2CC3=NN=C4N3C5=CC=CC=C5C(=O)N4C)C)C

DOS

IR

Vibrations