Geometry & MOs

Info

ID:	221044
PubChem CID:	85256600
Reduced:	N3C17H19 (1)
Stoich.:	A3B17C19 (1)
Weight, g/mol:	265.11365
ΔH_f, kcal/mol:	74.26
Dipole, Da:	3.02
IP(EA), eV:	-8.96(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylphenyl)sulfonyl-3-propylidenepyrrolidine

Drug info:

PubChemData

Smile

CN1C(C(N(C1=N)C)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations