Geometry & MOs

Info

ID:	158417
PubChem CID:	56463599
Reduced:	SN4O4C22H24 (1)
Stoich.:	AB4C4D22E24 (1)
Weight, g/mol:	383.224263
ΔH_f, kcal/mol:	-39.55
Dipole, Da:	4.45
IP(EA), eV:	-8.97(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[2-(dimethylamino)ethyl-[4-methyl-2-(2-methylpropyl)-1,3-thiazole-5-carbonyl]amino]acetate

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2CC2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=C4

DOS

IR

Vibrations