Geometry & MOs

Info

ID:	283411
PubChem CID:	103979748
Reduced:	NO3C13H13 (1)
Stoich.:	AB3C13D13 (1)
Weight, g/mol:	265.050571
ΔH_f, kcal/mol:	-85.6
Dipole, Da:	5.01
IP(EA), eV:	-9.65(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-chloro-1,3-benzoxazol-2-yl)cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CC(C(C1)C(=O)O)C2=NC3=CC=CC=C3O2

DOS

IR

Vibrations