Geometry & MOs

Info

ID:	159642
PubChem CID:	57288570
Reduced:	N4O4C23H26 (1)
Stoich.:	A4B4C23D26 (1)
Weight, g/mol:	450.222683
ΔH_f, kcal/mol:	-125.87
Dipole, Da:	4.67
IP(EA), eV:	-8.94(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxy-1-[2-[2,4,6-tris(but-2-enoxy)-2H-1,3,5-triazin-1-yl]ethyl]-1,3,5-triazinane-2,4-dione

Drug info:

PubChemData

Smile

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C(CC(=O)OCC4=CC=CC=C4)N

DOS

IR

Vibrations