Geometry & MOs

Info

ID:	303013
PubChem CID:	124489102
Reduced:	ClN3C10H14 (1)
Stoich.:	AB3C10D14 (1)
Weight, g/mol:	211.157229
ΔH_f, kcal/mol:	13.25
Dipole, Da:	2.08
IP(EA), eV:	-8.73(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-cyclohexyl-2-(cyclopropylamino)propanoic acid

Drug info:

PubChemData

Smile

C1C[C@H](CNC1)NC2=C(C=CC=N2)Cl

DOS

IR

Vibrations