Geometry & MOs

Info

ID:	343490
PubChem CID:	127266663
Reduced:	ClO2N6C12H13 (1)
Stoich.:	AB2C6D12E13 (1)
Weight, g/mol:	325.091869
ΔH_f, kcal/mol:	15.33
Dipole, Da:	1.56
IP(EA), eV:	-9.95(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-tert-butyl-1,3-thiazol-2-yl)ethyl]pyridine-4-sulfonamide

Drug info:

PubChemData

Smile

C1CN(CCC1(C2=NNN=N2)O)C(=O)C3=NC=C(C=C3)Cl

DOS

IR

Vibrations