Geometry & MOs

Info

ID:	1706
PubChem CID:	4909
Reduced:	NOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	218.105528
ΔH_f, kcal/mol:	-62.75
Dipole, Da:	4.54
IP(EA), eV:	-9.78(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-5-phenyl-1,3-diazinane-4,6-dione

Drug info:

PubChemData

Smile

CCC1(C(=O)NCNC1=O)C2=CC=CC=C2

DOS

IR

Vibrations