Geometry & MOs

Info

ID:	398359
PubChem CID:	135032947
Reduced:	FNO2C11H12 (1)
Stoich.:	ABC2D11E12 (1)
Weight, g/mol:	266.04582
ΔH_f, kcal/mol:	-104.3
Dipole, Da:	4.97
IP(EA), eV:	-9.72(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-chloro-6-methylphenyl)methyl]-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)/C=C/C[C@@H](C(=O)O)N

DOS

IR

Vibrations