Geometry & MOs

Info

ID:	29161
PubChem CID:	832067
Reduced:	NOSCl2H9C15 (1)
Stoich.:	ABCD2E9F15 (1)
Weight, g/mol:	309.093583
ΔH_f, kcal/mol:	8.8
Dipole, Da:	3.62
IP(EA), eV:	-9.04(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CS2)C(=O)NC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations