Geometry & MOs

Info

ID:	57609
PubChem CID:	22426143
Reduced:	NO5H17C20 (1)
Stoich.:	AB5C17D20 (1)
Weight, g/mol:	532.13359
ΔH_f, kcal/mol:	-142.09
Dipole, Da:	9.38
IP(EA), eV:	-9.26(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[5-(4-chlorophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxo-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=O)OC2=C1C=CC3=C2CN(CO3)CC4=CC=C(C=C4)C(=O)O

DOS

IR

Vibrations