Geometry & MOs

Info

ID:	191447
PubChem CID:	78148109
Reduced:	ClN2O3C18H21 (1)
Stoich.:	AB2C3D18E21 (1)
Weight, g/mol:	362.13972
ΔH_f, kcal/mol:	-140.97
Dipole, Da:	1.77
IP(EA), eV:	-9.4(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3-chlorophenyl)ethyl]-3-(2-methylcyclohexyl)-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CC1CCCC1N2C(=O)CC(=O)N(C2=O)CCC3=CC=C(C=C3)Cl

DOS

IR

Vibrations