Geometry & MOs

Info

ID:	375485
PubChem CID:	131529888
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	248.011933
ΔH_f, kcal/mol:	-83.24
Dipole, Da:	2.34
IP(EA), eV:	-8.29(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-amino-3-(5,6-dichloropyridin-3-yl)butanoic acid

Drug info:

PubChemData

Smile

C[C@H]1CCC2=C(N1)C(=CC=C2)C(=O)OC

DOS

IR

Vibrations