Geometry & MOs

Info

ID:	34225
PubChem CID:	7890377
Reduced:	N2O5C18H22 (1)
Stoich.:	A2B5C18D22 (1)
Weight, g/mol:	396.150764
ΔH_f, kcal/mol:	-205.93
Dipole, Da:	2.14
IP(EA), eV:	-9.56(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-methylanilino)-1,3-thiazol-4-yl]methyl 2-(2-propan-2-ylphenoxy)acetate

Drug info:

PubChemData

Smile

CCCC(=O)OCC1=C([C@@H](NC(=O)N1)C2=CC=CC=C2)C(=O)OCC

DOS

IR

Vibrations