Geometry & MOs

Info

ID:	6451
PubChem CID:	68638
Reduced:	NO4C13H19 (1)
Stoich.:	AB4C13D19 (1)
Weight, g/mol:	253.131408
ΔH_f, kcal/mol:	-182.02
Dipole, Da:	4.11
IP(EA), eV:	-8.98(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butanedioic acid;(2R)-1-phenylpropan-2-amine

Drug info:

PubChemData

Smile

C[C@H](CC1=CC=CC=C1)N.C(CC(=O)O)C(=O)O

DOS

IR

Vibrations