Geometry & MOs

Info

ID:	218057
PubChem CID:	85088802
Reduced:	O3C12H20 (2)
Stoich.:	A3B12C20 (2)
Weight, g/mol:	423.217605
ΔH_f, kcal/mol:	-331.97
Dipole, Da:	3.65
IP(EA), eV:	-9.54(0.51)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

3-amino-1-[4-azido-5-[[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxymethyl]oxolan-2-yl]-5-methylidenepyrimidin-1-ium-2,4-dione

Drug info:

PubChemData

Smile

CCC(C)C(=O)OC1CC(CC2C1C(CC=C2)CCC(CC(CC(=O)OC)O)O)C

DOS

IR

Vibrations