Geometry & MOs

Info

ID:	203087
PubChem CID:	79777146
Reduced:	ClN2O2C12H13 (1)
Stoich.:	AB2C2D12E13 (1)
Weight, g/mol:	238.050905
ΔH_f, kcal/mol:	-83.98
Dipole, Da:	4.61
IP(EA), eV:	-9.68(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-2-methylphenyl)-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC1CN(C(=O)NC1=O)C2=C(C(=CC=C2)Cl)C

DOS

IR

Vibrations