Geometry & MOs

Info

ID:	15013
PubChem CID:	427105
Reduced:	N2O5C17H22 (1)
Stoich.:	A2B5C17D22 (1)
Weight, g/mol:	334.152872
ΔH_f, kcal/mol:	-149.24
Dipole, Da:	6.06
IP(EA), eV:	-9.11(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;3-oxabicyclo[3.2.0]heptane-2,4-dione

Drug info:

PubChemData

Smile

CCC1C(COC1=O)CC2=CN=CN2C.C1CC2C1C(=O)OC2=O

DOS

IR

Vibrations