Geometry & MOs

Info

ID:	392658
PubChem CID:	135017546
Reduced:	NO3C8H13 (1)
Stoich.:	AB3C8D13 (1)
Weight, g/mol:	282.173213
ΔH_f, kcal/mol:	-119.99
Dipole, Da:	5.68
IP(EA), eV:	-9.47(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-dec-1-ynyl-5-phenyl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC(=O)OCCN(CC=C)C=O

DOS

IR

Vibrations