Geometry & MOs

Info

ID:	395247
PubChem CID:	135025017
Reduced:	ClO2F3H22C24 (1)
Stoich.:	AB2C3D22E24 (1)
Weight, g/mol:	221.120449
ΔH_f, kcal/mol:	-203.64
Dipole, Da:	1.31
IP(EA), eV:	-9.37(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-diphenyl-2,5-dihydropyrrole

Drug info:

PubChemData

Smile

CC1([C@@H]([C@H]1C(=O)O[C@H]2CC3=C(C2)C(=CC=C3)C4=CC=CC=C4)/C=C(/C(F)(F)F)\Cl)C

DOS

IR

Vibrations