Geometry & MOs

Info

ID:	84917
PubChem CID:	49870653
Reduced:	OSN3C17H19 (1)
Stoich.:	ABC3D17E19 (1)
Weight, g/mol:	296.163711
ΔH_f, kcal/mol:	8.01
Dipole, Da:	3.95
IP(EA), eV:	-8.7(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,4-diazatricyclo[4.3.1.13,8]undecan-4-yl)-5-phenyl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C1C2CC3CN(C2)CC1CN3C(=O)C4=NC=C5C(=C4)C=CS5

DOS

IR

Vibrations