Geometry & MOs

Info

ID:	229974
PubChem CID:	87569750
Reduced:	N2O9C18H20 (1)
Stoich.:	A2B9C18D20 (1)
Weight, g/mol:	500.114104
ΔH_f, kcal/mol:	-218.1
Dipole, Da:	9.06
IP(EA), eV:	-10.91(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4S)-4-carboxyperoxyoxolan-3-yl] (4-methoxyphenyl)-diphenylmethanesulfonate

Drug info:

PubChemData

Smile

CCOC(=O)CC1CC(C(C1[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-])(C(=O)C)C(=O)O

DOS

IR

Vibrations