Geometry & MOs

Info

ID:	203086
PubChem CID:	79777145
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	252.066555
ΔH_f, kcal/mol:	-80.88
Dipole, Da:	5.14
IP(EA), eV:	-8.99(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-2-methylphenyl)-5-methyl-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)N2CCC(=O)NC2=O

DOS

IR

Vibrations