Geometry & MOs

Info

ID:	15376
PubChem CID:	440041
Reduced:	NSO6C9H17 (1)
Stoich.:	ABC6D9E17 (1)
Weight, g/mol:	267.077658
ΔH_f, kcal/mol:	-281.79
Dipole, Da:	5.18
IP(EA), eV:	-9.19(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-4-[[(2S,3S,4R,5R)-3,4,5-trihydroxyoxolan-2-yl]methylsulfanyl]butanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations