Geometry & MOs

Info

ID:	192968
PubChem CID:	78330170
Reduced:	O2N6C13H24 (1)
Stoich.:	A2B6C13D24 (1)
Weight, g/mol:	310.156695
ΔH_f, kcal/mol:	-39.1
Dipole, Da:	8.02
IP(EA), eV:	-7.02(0.21)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

diethyl-[(4-fluorophenyl)-(4-hydroxy-2,6-dioxo-1,3-diazinan-5-yl)methyl]azanium

Drug info:

PubChemData

Smile

CC[N+]1=C(N=C2C1C(=O)N(C(=O)N2C)C)NCC[NH+](C)C

DOS

IR

Vibrations