Geometry & MOs

Info

ID:	140077
PubChem CID:	52642795
Reduced:	S2O3N5C18H25 (1)
Stoich.:	A2B3C5D18E25 (1)
Weight, g/mol:	304.088164
ΔH_f, kcal/mol:	-58.49
Dipole, Da:	12.21
IP(EA), eV:	-9.4(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(N-ethylanilino)-2-oxoethyl] 4-methyl-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=NN=C(S3)C(C)C

DOS

IR

Vibrations