Geometry & MOs

Info

ID:	287798
PubChem CID:	104294664
Reduced:	NF2O5H11C12 (1)
Stoich.:	AB2C5D11E12 (1)
Weight, g/mol:	316.00228
ΔH_f, kcal/mol:	-293.6
Dipole, Da:	3.94
IP(EA), eV:	-10.26(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)F)C(=O)N[C@H](CC(=O)O)C(=O)O

DOS

IR

Vibrations