Geometry & MOs

Info

ID:	207630
PubChem CID:	80429227
Reduced:	OS2N3C12H15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	231.050004
ΔH_f, kcal/mol:	20.28
Dipole, Da:	5.96
IP(EA), eV:	-8.83(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanylmethyl]morpholine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(C(CSC2=NC=NS2)O)N

DOS

IR

Vibrations