Geometry & MOs

Info

ID:	158484
PubChem CID:	56463954
Reduced:	F3O3N5C22H26 (1)
Stoich.:	A3B3C5D22E26 (1)
Weight, g/mol:	435.165034
ΔH_f, kcal/mol:	-208.11
Dipole, Da:	1.49
IP(EA), eV:	-9.12(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(benzenesulfonyl)piperidin-4-yl]methyl]-4-methyl-2-(2-methylpropyl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C1=NC(=NO1)C2=CC(=CC=C2)C(F)(F)F)N3CCN(CC3)C(=O)CCN4CCCC4=O

DOS

IR

Vibrations