Geometry & MOs

Info

ID:	184248
PubChem CID:	77133571
Reduced:	ClN2O3C9H13 (1)
Stoich.:	AB2C3D9E13 (1)
Weight, g/mol:	230.00699
ΔH_f, kcal/mol:	-149.88
Dipole, Da:	1.83
IP(EA), eV:	-10.31(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)CCCN1CC(C(=O)NC1=O)Cl

DOS

IR

Vibrations