Geometry & MOs

Info

ID:	415780
PubChem CID:	135088781
Reduced:	N3O3C22H23 (1)
Stoich.:	A3B3C22D23 (1)
Weight, g/mol:	343.136591
ΔH_f, kcal/mol:	-58.99
Dipole, Da:	2.94
IP(EA), eV:	-8.46(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-[(1-methylpyrrolidin-3-yl)methyl]acetamide

Drug info:

PubChemData

Smile

COC1=C(C=CC=N1)C(=O)N2CCC3(CC2)C4=C(CCO3)C5=CC=CC=C5N4

DOS

IR

Vibrations