Geometry & MOs

Info

ID:	369323
PubChem CID:	127332324
Reduced:	OSN3C13H19 (1)
Stoich.:	ABC3D13E19 (1)
Weight, g/mol:	258.060903
ΔH_f, kcal/mol:	-30.49
Dipole, Da:	2.48
IP(EA), eV:	-8.76(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dimethyl-N-(1,3,4-thiadiazol-2-yl)thiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1C(SCCN1C(=O)NC2=C(C=CC=N2)C)C

DOS

IR

Vibrations