Geometry & MOs

Info

ID:	383126
PubChem CID:	134974682
Reduced:	NO2C13H15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	353.92892
ΔH_f, kcal/mol:	-58.0
Dipole, Da:	1.43
IP(EA), eV:	-9.43(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-bromo-2-(bromomethyl)-2,3,4,5-tetrahydrocyclopenta[b]furan-3a-carboxylate

Drug info:

PubChemData

Smile

C/C=C\1/[C@H](CN(C1=O)CC2=CC=CC=C2)O

DOS

IR

Vibrations