Geometry & MOs

Info

ID:	150667
PubChem CID:	53790361
Reduced:	FN2O4H21C23 (1)
Stoich.:	AB2C4D21E23 (1)
Weight, g/mol:	338.114081
ΔH_f, kcal/mol:	-111.63
Dipole, Da:	0.89
IP(EA), eV:	-8.74(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-(oxiran-2-ylmethyl)-1,3-diphenyl-1,3,5-triazinan-1-ium-2,4,6-trione

Drug info:

PubChemData

Smile

C1CC1C2=C(C(=NN3C2=CC=C3)C4=CC=C(C=C4)F)C=CC(CC(=O)CC(=O)O)O

DOS

IR

Vibrations