Geometry & MOs

Info

ID:	303832
PubChem CID:	124490230
Reduced:	N2O5H22C23 (1)
Stoich.:	A2B5C22D23 (1)
Weight, g/mol:	181.092521
ΔH_f, kcal/mol:	-120.34
Dipole, Da:	6.9
IP(EA), eV:	-8.92(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-ethyl-2-thiophen-2-ylpyrrolidine

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N(C2=CC=CC=C2O1)CC(=O)N(CC3=CC=C(C=C3)O)CC4=CC=CO4

DOS

IR

Vibrations