Geometry & MOs

Info

ID:	306294
PubChem CID:	125003636
Reduced:	O2N5C17H23 (1)
Stoich.:	A2B5C17D23 (1)
Weight, g/mol:	406.183875
ΔH_f, kcal/mol:	-27.24
Dipole, Da:	2.29
IP(EA), eV:	-9.65(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N,N-diethyl-3-[4-(3-fluoroanilino)-6-methylpyridin-2-yl]pyrrolidine-1-sulfonamide

Drug info:

PubChemData

Smile

CC(C)C1=NN=C(O1)CCC(=O)N2CCC[C@@H](C2)C3=NC=NC=C3

DOS

IR

Vibrations