Geometry & MOs

Info

ID:	337961
PubChem CID:	127258584
Reduced:	BrNO3C10H16 (1)
Stoich.:	ABC3D10E16 (1)
Weight, g/mol:	342.92417
ΔH_f, kcal/mol:	-145.56
Dipole, Da:	5.62
IP(EA), eV:	-9.59(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butanoyl (2R)-3,4-dibromopyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CCCC(=O)OC(=O)[C@@]1(CC(CN1)Br)C

DOS

IR

Vibrations