Geometry & MOs

Info

ID:	372494
PubChem CID:	131298669
Reduced:	NO3C11H11 (1)
Stoich.:	AB3C11D11 (1)
Weight, g/mol:	273.00006
ΔH_f, kcal/mol:	-48.16
Dipole, Da:	3.74
IP(EA), eV:	-9.53(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-bromo-4-cyclopentyl-1,2-oxazole-5-carboxylate

Drug info:

PubChemData

Smile

C1C(CO1)OC2=CC=CC(=C2)C(C#N)O

DOS

IR

Vibrations