Geometry & MOs

Info

ID:	35748
PubChem CID:	7980279
Reduced:	NO4C19H21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	396.114378
ΔH_f, kcal/mol:	-130.61
Dipole, Da:	2.49
IP(EA), eV:	-9.02(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[4-(4-ethylphenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

CCC1=CC=CC(=C1NC(=O)COC(=O)COC2=CC=CC=C2)C

DOS

IR

Vibrations