Geometry & MOs

Info

ID:	27007
PubChem CID:	811132
Reduced:	ON2H9C10 (2)
Stoich.:	AB2C9D10 (2)
Weight, g/mol:	346.135114
ΔH_f, kcal/mol:	-9.94
Dipole, Da:	0.16
IP(EA), eV:	-9.26(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[(4-methylbenzoyl)-propylamino]methyl]-1,3-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC(=N3)C

DOS

IR

Vibrations