Geometry & MOs

Info

ID:	183182
PubChem CID:	76987065
Reduced:	N3O4C12H13 (1)
Stoich.:	A3B4C12D13 (1)
Weight, g/mol:	296.14601
ΔH_f, kcal/mol:	-27.1
Dipole, Da:	5.85
IP(EA), eV:	-10.3(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-1-(2-methylpropyl)-5-(3,3,3-trifluoropropylamino)-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC(C1=CC2=NC=NC(=O)C2C=C1[N+](=O)[O-])C(C)O

DOS

IR

Vibrations