Geometry & MOs

Info

ID:	18394
PubChem CID:	540196
Reduced:	N2O7H10C12 (1)
Stoich.:	A2B7C10D12 (1)
Weight, g/mol:	294.048801
ΔH_f, kcal/mol:	-100.31
Dipole, Da:	6.48
IP(EA), eV:	-11.12(-2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetyl-3-(2,4-dinitrophenyl)oxolan-2-one

Drug info:

PubChemData

Smile

CC(=O)C1(CCOC1=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations