Geometry & MOs

Info

ID:	24108
PubChem CID:	607883
Reduced:	ClN2O2H7C11 (1)
Stoich.:	AB2C2D7E11 (1)
Weight, g/mol:	234.019605
ΔH_f, kcal/mol:	-26.21
Dipole, Da:	5.55
IP(EA), eV:	-9.3(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-5H-[1,3]oxazolo[4,5-c]quinolin-4-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(C(=O)N2)N=C(O3)CCl

DOS

IR

Vibrations