Geometry & MOs

Info

ID:	167872
PubChem CID:	74887950
Reduced:	ON3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	335.02694
ΔH_f, kcal/mol:	-25.89
Dipole, Da:	6.59
IP(EA), eV:	-8.42(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[(5-bromofuran-2-yl)methylamino]phenyl]pyrazolidin-3-one

Drug info:

PubChemData

Smile

C1CCC(CC1)CNC2=CC=C(C=C2)C3CC(=O)NN3

DOS

IR

Vibrations