Geometry & MOs

Info

ID:	156789
PubChem CID:	56385631
Reduced:	NSO5H19C23 (1)
Stoich.:	ABC5D19E23 (1)
Weight, g/mol:	444.196154
ΔH_f, kcal/mol:	-103.1
Dipole, Da:	2.56
IP(EA), eV:	-8.81(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-fluoro-2-phenyl-1H-indol-3-yl)-N-methyl-N-[2-[(4-methylpyridin-2-yl)amino]-2-oxoethyl]propanamide

Drug info:

PubChemData

Smile

CS(=O)(=O)CC1=C(OC2=CC=CC=C21)C(=O)NC3=CC=CC=C3OC4=CC=CC=C4

DOS

IR

Vibrations