Geometry & MOs

Info

ID:	239973
PubChem CID:	93375402
Reduced:	ON3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	231.137162
ΔH_f, kcal/mol:	-0.01
Dipole, Da:	9.29
IP(EA), eV:	-8.89(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-[(2S)-2-cyanopropyl]-N-methyl-2-phenylacetamide

Drug info:

PubChemData

Smile

C[C@H](CN(C)C(=O)C1=CC=C(C=C1)N)C#N

DOS

IR

Vibrations