Geometry & MOs

Info

ID:	267998
PubChem CID:	103594566
Reduced:	FN2C12H17 (1)
Stoich.:	AB2C12D17 (1)
Weight, g/mol:	290.120132
ΔH_f, kcal/mol:	-44.95
Dipole, Da:	2.95
IP(EA), eV:	-9.11(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-3-[3-(4-methylthiomorpholin-3-yl)-1,2,4-oxadiazol-5-yl]aniline

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1F)NCCC(N2)(C)C

DOS

IR

Vibrations