Geometry & MOs

Info

ID:	55794
PubChem CID:	17396549
Reduced:	N2O5C20H22 (1)
Stoich.:	A2B5C20D22 (1)
Weight, g/mol:	353.96738
ΔH_f, kcal/mol:	-164.28
Dipole, Da:	2.69
IP(EA), eV:	-9.5(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-acetamido-1,3-thiazol-4-yl)methyl 3-bromobenzoate

Drug info:

PubChemData

Smile

CC1=C(NC(=C1C(=O)OC)C)C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3

DOS

IR

Vibrations