Geometry & MOs

Info

ID:	345168
PubChem CID:	127268928
Reduced:	SO2N3C11H19 (1)
Stoich.:	AB2C3D11E19 (1)
Weight, g/mol:	267.092915
ΔH_f, kcal/mol:	-74.19
Dipole, Da:	5.46
IP(EA), eV:	-9.29(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)-3-methylpyrrolidine

Drug info:

PubChemData

Smile

CC1CCN(C1)S(=O)(=O)C2=C(N(N=C2C)C)C

DOS

IR

Vibrations