Geometry & MOs

Info

ID:	381071
PubChem CID:	134971702
Reduced:	BrO4C5H7 (1)
Stoich.:	AB4C5D7 (1)
Weight, g/mol:	201.045964
ΔH_f, kcal/mol:	-170.47
Dipole, Da:	2.07
IP(EA), eV:	-10.94(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methoxy-5-methyl-1,3-thiazol-4-yl)methyl acetate

Drug info:

PubChemData

Smile

C(C1[C@@H]([C@@H](C(=O)O1)O)O)Br

DOS

IR

Vibrations