Geometry & MOs

Info

ID:	387932
PubChem CID:	134987452
Reduced:	BrNC10H14 (1)
Stoich.:	ABC10D14 (1)
Weight, g/mol:	243.110673
ΔH_f, kcal/mol:	29.03
Dipole, Da:	4.03
IP(EA), eV:	-9.51(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (2S,5R)-5-(2-oxopropyl)pyrrolidine-1,2-dicarboxylate

Drug info:

PubChemData

Smile

C/C(=C(\[N+]#[C-])/Br)/C1CCCCC1

DOS

IR

Vibrations