Geometry & MOs

Info

ID:	41152
PubChem CID:	8145368
Reduced:	N4O5C21H24 (1)
Stoich.:	A4B5C21D24 (1)
Weight, g/mol:	428.242356
ΔH_f, kcal/mol:	-140.19
Dipole, Da:	7.28
IP(EA), eV:	-8.34(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]-3-[(1S,2R)-2-methylcyclohexyl]imidazolidine-2,4,5-trione

Drug info:

PubChemData

Smile

C/C(=N/NC(=O)COC1=CC=C(C=C1)OC)/CC(=O)NC2=CC=C(C=C2)NC(=O)C

DOS

IR

Vibrations