Geometry & MOs

Info

ID:	220414
PubChem CID:	85182455
Reduced:	F3N3O3H20C26 (1)
Stoich.:	A3B3C3D20E26 (1)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	-120.56
Dipole, Da:	5.95
IP(EA), eV:	-9.13(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 1,2-dibenzylpyrazolidine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)CON=C(C2=CC(=CC=C2)C(F)(F)F)C3=CN(N=C3)C4=CC=CC=C4

DOS

IR

Vibrations