Geometry & MOs

Info

ID:	14819
PubChem CID:	421530
Reduced:	ClNH6C7 (3)
Stoich.:	ABC6D7 (3)
Weight, g/mol:	417.056631
ΔH_f, kcal/mol:	74.09
Dipole, Da:	3.82
IP(EA), eV:	-9.04(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,6-tris(4-chlorophenyl)-1,3,5-triazinane

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2NC(NC(N2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)Cl

DOS

IR

Vibrations