Geometry & MOs

Info

ID:	269508
PubChem CID:	103617789
Reduced:	BrN2O2C12H13 (1)
Stoich.:	AB2C2D12E13 (1)
Weight, g/mol:	344.00217
ΔH_f, kcal/mol:	-61.99
Dipole, Da:	7.24
IP(EA), eV:	-9.6(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-iodobenzoyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC1C(=O)N)C(=O)C2=CC(=CC=C2)Br

DOS

IR

Vibrations