Geometry & MOs

Info

ID:	205482
PubChem CID:	80109638
Reduced:	OF2N3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	263.14339
ΔH_f, kcal/mol:	-70.66
Dipole, Da:	3.34
IP(EA), eV:	-9.75(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4-methylpentan-1-amine

Drug info:

PubChemData

Smile

CC(C)CC(CN)C1=NC(=NO1)C2=CC(=CC(=C2)F)F

DOS

IR

Vibrations