Geometry & MOs

Info

ID:	394364
PubChem CID:	135022843
Reduced:	N2O5H22C25 (1)
Stoich.:	A2B5C22D25 (1)
Weight, g/mol:	242.13068
ΔH_f, kcal/mol:	-55.67
Dipole, Da:	8.86
IP(EA), eV:	-9.31(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(3-phenylpropyl)-3-prop-2-enylfuran-2-one

Drug info:

PubChemData

Smile

C1[C@@H](C(=O)O[C@]12CC(CO2)(C3=CC=CC=C3)C4=CC=CC=C4)NC5=CC(=CC=C5)[N+](=O)[O-]

DOS

IR

Vibrations