Geometry & MOs

Info

ID:	30676
PubChem CID:	841700
Reduced:	OS2N3C12H15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	280.01856
ΔH_f, kcal/mol:	-15.7
Dipole, Da:	2.67
IP(EA), eV:	-8.94(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=C(NC1=S)SC3=C2CCN(C3)C

DOS

IR

Vibrations