Geometry & MOs

Info

ID:	209567
PubChem CID:	80688287
Reduced:	ClSN2O2C10H15 (1)
Stoich.:	ABC2D2E10F15 (1)
Weight, g/mol:	248.99749
ΔH_f, kcal/mol:	-77.38
Dipole, Da:	10.32
IP(EA), eV:	-9.07(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-amino-2-oxoethyl)-methylamino]-4-chloro-1,3-thiazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CCC(C)CN(C)C1=NC(=C(S1)C(=O)O)Cl

DOS

IR

Vibrations