Geometry & MOs

Info

ID:	205480
PubChem CID:	80109636
Reduced:	ON3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	263.14339
ΔH_f, kcal/mol:	23.69
Dipole, Da:	1.98
IP(EA), eV:	-9.57(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(3-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

DOS

IR

Vibrations