Geometry & MOs

Info

ID:	175184
PubChem CID:	75864758
Reduced:	O3N4C27H28 (1)
Stoich.:	A3B4C27D28 (1)
Weight, g/mol:	451.185569
ΔH_f, kcal/mol:	-57.18
Dipole, Da:	5.86
IP(EA), eV:	-8.19(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl]-5-(4-nitrophenyl)imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CN3C(=O)C(NC3=O)(C)C4=CC=CC5=CC=CC=C54

DOS

IR

Vibrations