Geometry & MOs

Info

ID:	157623
PubChem CID:	56436152
Reduced:	SO3N4C21H32 (1)
Stoich.:	AB3C4D21E32 (1)
Weight, g/mol:	402.154804
ΔH_f, kcal/mol:	-109.18
Dipole, Da:	5.53
IP(EA), eV:	-9.0(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-ditert-butylpyrazol-3-yl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)NC1=CC=CC(=C1)C(=O)NC2=CC(=NN2C(C)(C)C)C(C)(C)C

DOS

IR

Vibrations