Geometry & MOs

Info

ID:	191436
PubChem CID:	78146199
Reduced:	BrN3O3F6C10H10 (1)
Stoich.:	AB3C3D6E10F10 (1)
Weight, g/mol:	307.03916
ΔH_f, kcal/mol:	-438.08
Dipole, Da:	2.73
IP(EA), eV:	-10.38(-2.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dioxo-1,3-diazinan-5-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide

Drug info:

PubChemData

Smile

CN1C(CC(=O)N(C1=O)C)NC(=O)C(C(F)(F)F)(C(F)(F)F)Br

DOS

IR

Vibrations