Geometry & MOs

Info

ID:	340882
PubChem CID:	127263317
Reduced:	BrN2C6H9 (1)
Stoich.:	AB2C6D9 (1)
Weight, g/mol:	127.063329
ΔH_f, kcal/mol:	21.83
Dipole, Da:	1.54
IP(EA), eV:	-9.21(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methyl-5-oxopyrrolidine-2-carbaldehyde

Drug info:

PubChemData

Smile

C1C2C1(CNC2)C#N.Br

DOS

IR

Vibrations