Geometry & MOs

Info

ID:	369319
PubChem CID:	127332320
Reduced:	OSN3C12H17 (1)
Stoich.:	ABC3D12E17 (1)
Weight, g/mol:	257.065654
ΔH_f, kcal/mol:	-21.9
Dipole, Da:	5.81
IP(EA), eV:	-8.91(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1C(SCCN1C(=O)NC2=CN=CC=C2)C

DOS

IR

Vibrations