Geometry & MOs

Info

ID:	273926
PubChem CID:	103805890
Reduced:	SBr2O2N3C11H13 (1)
Stoich.:	AB2C2D3E11F13 (1)
Weight, g/mol:	268.099397
ΔH_f, kcal/mol:	-29.59
Dipole, Da:	0.32
IP(EA), eV:	-9.26(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1)C(=O)CNC(=O)C2=C(SC(=C2)Br)Br

DOS

IR

Vibrations