Geometry & MOs

Info

ID:	7531
PubChem CID:	73239
Reduced:	SN2O2C12H12 (1)
Stoich.:	AB2C2D12E12 (1)
Weight, g/mol:	248.061949
ΔH_f, kcal/mol:	-34.62
Dipole, Da:	2.33
IP(EA), eV:	-8.95(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-amino-4-phenyl-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N=C(S1)N)C2=CC=CC=C2

DOS

IR

Vibrations