Geometry & MOs

Info

ID:	302750
PubChem CID:	124394450
Reduced:	SN2O5C20H26 (1)
Stoich.:	AB2C5D20E26 (1)
Weight, g/mol:	424.127051
ΔH_f, kcal/mol:	-175.73
Dipole, Da:	6.73
IP(EA), eV:	-8.29(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-ethoxy-4-[(Z)-[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenyl] acetate

Drug info:

PubChemData

Smile

CC[C@@H](C)NC(=O)COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)OCC

DOS

IR

Vibrations