Geometry & MOs

Info

ID:	155635
PubChem CID:	56366494
Reduced:	FSO4N5C23H26 (1)
Stoich.:	ABC4D5E23F26 (1)
Weight, g/mol:	471.128649
ΔH_f, kcal/mol:	-136.93
Dipole, Da:	1.78
IP(EA), eV:	-9.19(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenyl)-N-[(3-piperidin-1-ylsulfonylphenyl)methyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)CNC(=O)C3=NN(C(C3)C(=O)N)C4=CC=C(C=C4)F

DOS

IR

Vibrations