Geometry & MOs

Info

ID:	408416
PubChem CID:	135081182
Reduced:	O3C4N4H8 (1)
Stoich.:	A3B4C4D8 (1)
Weight, g/mol:	230.102848
ΔH_f, kcal/mol:	-62.61
Dipole, Da:	2.22
IP(EA), eV:	-10.42(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(2R,3S)-2-amino-3-[(4R,5S)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]-3-hydroxypropanoate

Drug info:

PubChemData

Smile

C([C@@H]([C@H](C(=O)O)N)O)N=[N+]=[N-]

DOS

IR

Vibrations