Geometry & MOs

Info

ID:	305078
PubChem CID:	124766498
Reduced:	N2O6C7H14 (1)
Stoich.:	A2B6C7D14 (1)
Weight, g/mol:	222.085186
ΔH_f, kcal/mol:	-273.21
Dipole, Da:	5.32
IP(EA), eV:	-10.14(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3S,4S,5R,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea

Drug info:

PubChemData

Smile

C([C@@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O)NC(=O)N)O)O)O

DOS

IR

Vibrations