Geometry & MOs

Info

ID:	48822
PubChem CID:	11528366
Reduced:	ON3C7H7 (1)
Stoich.:	AB3C7D7 (1)
Weight, g/mol:	150.052823
ΔH_f, kcal/mol:	10.7
Dipole, Da:	5.96
IP(EA), eV:	-8.9(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-3,4,5-trihydroxypentanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=O)C2=C(N1)C=NN2

DOS

IR

Vibrations