Geometry & MOs

Info

ID:	397978
PubChem CID:	135031251
Reduced:	NH25C33 (1)
Stoich.:	AB25C33 (1)
Weight, g/mol:	459.147985
ΔH_f, kcal/mol:	173.11
Dipole, Da:	2.07
IP(EA), eV:	-8.18(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylphenyl)sulfonyl-4,4-diphenyl-2-(2,2,2-trifluoroethyl)pyrrolidine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2C3C(C=CC3=C(C4=CC=CC=C4)C5=CC=CC=C5)C6=C2C7=CC=CC=C7N6

DOS

IR

Vibrations