Geometry & MOs

Info

ID:	423166
PubChem CID:	135119040
Reduced:	FSN5C12H16 (1)
Stoich.:	ABC5D12E16 (1)
Weight, g/mol:	289.179027
ΔH_f, kcal/mol:	20.84
Dipole, Da:	5.15
IP(EA), eV:	-8.42(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-ethylphenoxy)ethyl]-N-methyl-5-propan-2-yl-1,2,4-oxadiazol-3-amine

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CNC2=NC=C(C(=N2)N(C)C)F)C

DOS

IR

Vibrations