Geometry & MOs

Info

ID:	28149
PubChem CID:	825855
Reduced:	NO4H11C15 (1)
Stoich.:	AB4C11D15 (1)
Weight, g/mol:	310.120509
ΔH_f, kcal/mol:	-23.17
Dipole, Da:	2.93
IP(EA), eV:	-9.96(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,2S)-2-benzoyloxycyclopentyl] benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2[N+](=O)[O-]

DOS

IR

Vibrations