Geometry & MOs

Info

ID:	288878
PubChem CID:	104327600
Reduced:	FNO3C16H20 (1)
Stoich.:	ABC3D16E20 (1)
Weight, g/mol:	298.0117
ΔH_f, kcal/mol:	-187.36
Dipole, Da:	5.29
IP(EA), eV:	-10.13(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-bromopropyl)-5-(4-fluoro-2-methylphenyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(=O)NC2CCCCC2(C)C(=O)O

DOS

IR

Vibrations