Geometry & MOs

Info

ID:	35711
PubChem CID:	7980230
Reduced:	NSO6C20H23 (1)
Stoich.:	ABC6D20E23 (1)
Weight, g/mol:	410.130028
ΔH_f, kcal/mol:	-210.5
Dipole, Da:	4.93
IP(EA), eV:	-8.92(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(N1[C@H]2CCS(=O)(=O)C2)C)C(=O)COC(=O)COC3=CC=CC=C3

DOS

IR

Vibrations