Geometry & MOs

Info

ID:	29189
PubChem CID:	832246
Reduced:	N2O2C5H9 (2)
Stoich.:	A2B2C5D9 (2)
Weight, g/mol:	314.122634
ΔH_f, kcal/mol:	-183.25
Dipole, Da:	4.72
IP(EA), eV:	-10.02(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3aS,6aR)-6-(acetyloxymethyl)-1,4-dimethyl-2,5-dioxo-3a,6a-dihydroimidazo[4,5-d]imidazol-3-yl]methyl acetate

Drug info:

PubChemData

Smile

CCN1[C@H]2[C@H](N(C(=O)N2CO)CC)N(C1=O)CO

DOS

IR

Vibrations