Geometry & MOs

Info

ID:	264713
PubChem CID:	103484776
Reduced:	NO4C15H25 (1)
Stoich.:	AB4C15D25 (1)
Weight, g/mol:	289.11365
ΔH_f, kcal/mol:	-212.82
Dipole, Da:	3.53
IP(EA), eV:	-9.21(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[2-(2-ethylphenyl)-1,3-thiazol-4-yl]propanoate

Drug info:

PubChemData

Smile

CCC1CCC(=O)N(CC1)CC(=O)CCC(=O)OCC

DOS

IR

Vibrations