Geometry & MOs

Info

ID:	268291
PubChem CID:	103598768
Reduced:	SO2N6C18H20 (1)
Stoich.:	AB2C6D18E20 (1)
Weight, g/mol:	344.119464
ΔH_f, kcal/mol:	57.68
Dipole, Da:	5.06
IP(EA), eV:	-9.14(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[benzyl-[3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]amino]acetate

Drug info:

PubChemData

Smile

CC1=NN=NN1C(=CC2=CC(=CC=C2)OC)C(=O)N(C)CC3=CSC(=N3)C

DOS

IR

Vibrations