Geometry & MOs

Info

ID:	13
PubChem CID:	1951
Reduced:	O3N4F5C28H29 (1)
Stoich.:	A3B4C5D28E29 (1)
Weight, g/mol:	564.215982
ΔH_f, kcal/mol:	-315.49
Dipole, Da:	7.19
IP(EA), eV:	-8.64(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(methylamino)-3-phenylpropanoyl]-N-[4,4,5,5,5-pentafluoro-1-(1H-indol-3-yl)-3-oxopentan-2-yl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CNC(CC1=CC=CC=C1)C(=O)N2CCCC2C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)C(C(F)(F)F)(F)F

DOS

IR

Vibrations