Geometry & MOs

Info

ID:	381200
PubChem CID:	134971858
Reduced:	NOC13H14 (2)
Stoich.:	ABC13D14 (2)
Weight, g/mol:	305.072179
ΔH_f, kcal/mol:	-31.92
Dipole, Da:	2.04
IP(EA), eV:	-9.02(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(1-benzoyloxyethyl)-1,3-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CCC[C@@H]1[C@H]2[C@@H](CC3=C1CN(C3)CC4=CC=CC=C4)C(=O)N(C2=O)C5=CC=CC=C5

DOS

IR

Vibrations