Geometry & MOs

Info

ID:	343973
PubChem CID:	127267149
Reduced:	NSF2O5C13H17 (1)
Stoich.:	ABC2D5E13F17 (1)
Weight, g/mol:	347.089304
ΔH_f, kcal/mol:	-314.75
Dipole, Da:	2.63
IP(EA), eV:	-8.98(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-fluorophenoxy)butyl]-5-(trifluoromethyl)-1,3,4-oxadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=C(C=C1)NS(=O)(=O)CCC(C)(F)F)O

DOS

IR

Vibrations