Geometry & MOs

Info

ID:	210064
PubChem CID:	80757045
Reduced:	ON5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	244.142307
ΔH_f, kcal/mol:	11.23
Dipole, Da:	2.14
IP(EA), eV:	-8.5(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(1-cyclopentylethylcarbamoylamino)-3-hydroxypropanoic acid

Drug info:

PubChemData

Smile

CCOC1=NC(=NC(=N1)N2CCCC3=C2C=CC(=C3)C)N

DOS

IR

Vibrations