Geometry & MOs

Info

ID:	303896
PubChem CID:	124490730
Reduced:	OBr3H5C8 (1)
Stoich.:	AB3C5D8 (1)
Weight, g/mol:	325.03136
ΔH_f, kcal/mol:	-5.6
Dipole, Da:	2.05
IP(EA), eV:	-9.94(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (2S)-1-(2-bromoacetyl)pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1[C@H](C(=O)Br)Br)Br

DOS

IR

Vibrations