Geometry & MOs

Info

ID:	317987
PubChem CID:	126648219
Reduced:	N2O4C17H18 (1)
Stoich.:	A2B4C17D18 (1)
Weight, g/mol:	329.047027
ΔH_f, kcal/mol:	-116.47
Dipole, Da:	1.97
IP(EA), eV:	-8.63(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-3-oxo-1,4-benzoxazine-6-carboxylic acid

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2CC(OC3=C2C=C(C=C3)C(=O)N)O

DOS

IR

Vibrations