Geometry & MOs

Info

ID:	374103
PubChem CID:	131323725
Reduced:	NBr2O3C10H13 (1)
Stoich.:	AB2C3D10E13 (1)
Weight, g/mol:	223.089167
ΔH_f, kcal/mol:	-115.5
Dipole, Da:	3.66
IP(EA), eV:	-9.26(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-methyl-1-N-([1,2]thiazolo[5,4-d]pyrimidin-6-yl)propane-1,2-diamine

Drug info:

PubChemData

Smile

C[C@](CO)([C@@H](C1=CC(=C(C(=C1)Br)O)Br)N)O

DOS

IR

Vibrations