Geometry & MOs

Info

ID:	148781
PubChem CID:	53788450
Reduced:	NOC6H11 (1)
Stoich.:	ABC6D11 (1)
Weight, g/mol:	224.053217
ΔH_f, kcal/mol:	-29.1
Dipole, Da:	4.14
IP(EA), eV:	-9.51(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S,4R,5S)-3,4,5,6-tetrahydroxy-2-oxohexyl] hydrogen carbonate

Drug info:

PubChemData

Smile

CCN(C=O)C1CC1

DOS

IR

Vibrations