Geometry & MOs

Info

ID:	139644
PubChem CID:	52574279
Reduced:	NO2C23H27 (1)
Stoich.:	AB2C23D27 (1)
Weight, g/mol:	288.129634
ΔH_f, kcal/mol:	-38.78
Dipole, Da:	4.72
IP(EA), eV:	-8.68(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dimethylphenyl)-N-ethyl-2,4-dimethyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCC(=O)N([C@H]2CCCC3=CC=CC=C23)C4CC4

DOS

IR

Vibrations