Geometry & MOs

Info

ID:	64363
PubChem CID:	29199328
Reduced:	ClFON3H15C18 (1)
Stoich.:	ABCD3E15F18 (1)
Weight, g/mol:	430.183875
ΔH_f, kcal/mol:	0.38
Dipole, Da:	3.86
IP(EA), eV:	-8.82(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-N-[(2R)-2-(1H-indol-3-yl)-2-(4-methylpiperazin-1-yl)ethyl]-2-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1C(=O)N(C)C2=CC=CC=C2)Cl)C3=CC=C(C=C3)F

DOS

IR

Vibrations