Geometry & MOs

Info

ID:	314844
PubChem CID:	126623676
Reduced:	NO3C5H11 (1)
Stoich.:	AB3C5D11 (1)
Weight, g/mol:	388.05463
ΔH_f, kcal/mol:	-135.97
Dipole, Da:	3.95
IP(EA), eV:	-9.76(1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-bromopyridin-2-yl)carbamoyl]-4-[(dimethylamino)methyl]-4-fluoropyrrolidine-1-carboxylic acid

Drug info:

PubChemData

Smile

C1[C@H]([C@@H]([C@@H](CO1)O)O)N

DOS

IR

Vibrations