Geometry & MOs

Info

ID:	167874
PubChem CID:	74887952
Reduced:	ON3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	283.132077
ΔH_f, kcal/mol:	-25.13
Dipole, Da:	6.54
IP(EA), eV:	-8.44(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)CCNC1=CC=C(C=C1)C2CC(=O)NN2

DOS

IR

Vibrations