Geometry & MOs

Info

ID:	388075
PubChem CID:	134988075
Reduced:	IH2O2C5F7 (1)
Stoich.:	AB2C2D5E7 (1)
Weight, g/mol:	187.120843
ΔH_f, kcal/mol:	-417.25
Dipole, Da:	3.07
IP(EA), eV:	-10.38(-2.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2R,3S)-2-amino-3-hydroxy-5-methylhex-4-enoate

Drug info:

PubChemData

Smile

C(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)I

DOS

IR

Vibrations