Geometry & MOs

Info

ID:	14128
PubChem CID:	405019
Reduced:	BrSO3N4C13H15 (1)
Stoich.:	ABC3D4E13F15 (1)
Weight, g/mol:	386.00482
ΔH_f, kcal/mol:	-99.5
Dipole, Da:	6.83
IP(EA), eV:	-8.72(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-amino-3-benzamido-2-imino-1,3-thiazole-5-carboxylate;hydrobromide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(C(=N)S1)NC(=O)C2=CC=CC=C2)N.Br

DOS

IR

Vibrations