Geometry & MOs

Info

ID:	83502
PubChem CID:	49857667
Reduced:	ON2H10C16 (1)
Stoich.:	AB2C10D16 (1)
Weight, g/mol:	238.112899
ΔH_f, kcal/mol:	88.85
Dipole, Da:	3.08
IP(EA), eV:	-9.39(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(difluoromethyl)-5-(propanoylamino)pentanoic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CO2)/C(=C/C3=CN=CC=C3)/C#N

DOS

IR

Vibrations