Geometry & MOs

Info

ID:	281364
PubChem CID:	103913764
Reduced:	FN2H15C16 (1)
Stoich.:	AB2C15D16 (1)
Weight, g/mol:	217.121512
ΔH_f, kcal/mol:	24.62
Dipole, Da:	1.1
IP(EA), eV:	-9.33(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-phenylethanamine

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)NCC2=C(C=CC(=C2)F)C#N

DOS

IR

Vibrations