Geometry & MOs

Info

ID:	120734
PubChem CID:	50742487
Reduced:	FSO2N3C15H18 (1)
Stoich.:	ABC2D3E15F18 (1)
Weight, g/mol:	347.166748
ΔH_f, kcal/mol:	-61.31
Dipole, Da:	7.17
IP(EA), eV:	-9.5(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-methyl-1,1-dioxo-5-(4-propan-2-ylphenyl)-1,2-thiazol-3-yl]piperidin-4-amine

Drug info:

PubChemData

Smile

CC1=C(S(=O)(=O)N=C1N2CCCNCC2)C3=CC=C(C=C3)F

DOS

IR

Vibrations