Geometry & MOs

Info

ID:	166280
PubChem CID:	74662323
Reduced:	Cl2O3N4H16C21 (1)
Stoich.:	A2B3C4D16E21 (1)
Weight, g/mol:	376.109293
ΔH_f, kcal/mol:	-4.06
Dipole, Da:	7.63
IP(EA), eV:	-9.12(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[3-(3-methoxy-4-propoxyphenyl)prop-2-enoylamino]-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NN3C(CC(=O)N=C3C2=C)C(=O)NC4=C(C=C(C=C4)Cl)Cl

DOS

IR

Vibrations