Geometry & MOs

Info

ID:	57694
PubChem CID:	22433416
Reduced:	SN2O3C16H18 (1)
Stoich.:	AB2C3D16E18 (1)
Weight, g/mol:	438.153262
ΔH_f, kcal/mol:	-85.49
Dipole, Da:	3.37
IP(EA), eV:	-8.76(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]-N-propylbenzamide

Drug info:

PubChemData

Smile

CCN(C1=NC(=CS1)C2=CC=C(C=C2)C)C(=O)CC(=O)OC

DOS

IR

Vibrations