Geometry & MOs

Info

ID:	200523
PubChem CID:	79404937
Reduced:	OSN6C7H14 (1)
Stoich.:	ABC6D7E14 (1)
Weight, g/mol:	261.114713
ΔH_f, kcal/mol:	29.04
Dipole, Da:	5.37
IP(EA), eV:	-9.55(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-butyl-1,2,4-oxadiazol-5-yl)-3-methylsulfonylpropan-1-amine

Drug info:

PubChemData

Smile

CC(C(C)SC1=NN=CN1N)C(=O)NN

DOS

IR

Vibrations