Geometry & MOs

Info

ID:	14131
PubChem CID:	405082
Reduced:	N2O5H20C21 (1)
Stoich.:	A2B5C20D21 (1)
Weight, g/mol:	380.137222
ΔH_f, kcal/mol:	-174.25
Dipole, Da:	5.36
IP(EA), eV:	-9.42(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(4-methoxyphenyl)-1-(4-methylphenyl)-3-oxopropyl]-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)OC)C3C(=O)NC(=O)NC3=O

DOS

IR

Vibrations