Geometry & MOs

Info

ID:	140378
PubChem CID:	52687867
Reduced:	BrFNO3H15C17 (1)
Stoich.:	ABCD3E15F17 (1)
Weight, g/mol:	438.169191
ΔH_f, kcal/mol:	-129.03
Dipole, Da:	4.79
IP(EA), eV:	-9.66(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4S)-4-(1H-indol-3-ylmethyl)-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)CNC(=O)CC2=CC(=C(C=C2)F)Br

DOS

IR

Vibrations