Geometry & MOs

Info

ID:	45694
PubChem CID:	10516575
Reduced:	N2O5H12C13 (1)
Stoich.:	A2B5C12D13 (1)
Weight, g/mol:	276.157288
ΔH_f, kcal/mol:	-90.05
Dipole, Da:	5.16
IP(EA), eV:	-10.2(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-[(2S)-2-(diethoxymethyl)oxiran-2-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1[N+](=O)[O-])C)C(=O)C=C(C(=O)N2)OC

DOS

IR

Vibrations