Geometry & MOs

Info

ID:	243906
PubChem CID:	99300588
Reduced:	ClON3H16C22 (1)
Stoich.:	ABC3D16E22 (1)
Weight, g/mol:	443.130363
ΔH_f, kcal/mol:	74.82
Dipole, Da:	6.5
IP(EA), eV:	-8.72(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-4-methoxy-3-phenylbenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=CC=C2NC(=O)C3=NN(C=C3)C4=CC=CC=C4Cl

DOS

IR

Vibrations