Geometry & MOs

Info

ID:	35712
PubChem CID:	7980232
Reduced:	SN2O4C22H22 (1)
Stoich.:	AB2C4D22E22 (1)
Weight, g/mol:	410.130028
ΔH_f, kcal/mol:	-97.96
Dipole, Da:	6.37
IP(EA), eV:	-8.89(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(N-acetyl-2-ethylanilino)-1,3-thiazol-4-yl]methyl 2-phenoxyacetate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N(C2=NC(=CS2)COC(=O)COC3=CC=CC=C3)C(=O)C)C

DOS

IR

Vibrations