Geometry & MOs

Info

ID:	388607
PubChem CID:	134989634
Reduced:	N3C7H7 (1)
Stoich.:	A3B7C7 (1)
Weight, g/mol:	251.076928
ΔH_f, kcal/mol:	71.16
Dipole, Da:	1.73
IP(EA), eV:	-11.02(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(1R)-2-methylidenecyclopentyl]-2-[(2,2,2-trifluoroacetyl)amino]acetic acid

Drug info:

PubChemData

Smile

CC1=NC[C@@H]([C@H]1C#N)C#N

DOS

IR

Vibrations