Geometry & MOs

Info

ID:	269507
PubChem CID:	103617788
Reduced:	FN2O2C12H13 (1)
Stoich.:	AB2C2D12E13 (1)
Weight, g/mol:	296.01604
ΔH_f, kcal/mol:	-111.33
Dipole, Da:	3.16
IP(EA), eV:	-9.85(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromobenzoyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC1C(=O)N)C(=O)C2=CC=CC=C2F

DOS

IR

Vibrations