Geometry & MOs

Info

ID:	398500
PubChem CID:	135033521
Reduced:	N2O3C20H24 (1)
Stoich.:	A2B3C20D24 (1)
Weight, g/mol:	324.01095
ΔH_f, kcal/mol:	-83.64
Dipole, Da:	4.89
IP(EA), eV:	-8.55(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-bromophenyl)methyl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CC(=O)C1CN2CCC1CC2[C@@H](C3=C4C=C(C=CC4=NC=C3)OC)O

DOS

IR

Vibrations