Geometry & MOs

Info

ID:	448766
PubChem CID:	135293467
Reduced:	ON4F5H21C23 (1)
Stoich.:	AB4C5D21E23 (1)
Weight, g/mol:	477.153636
ΔH_f, kcal/mol:	-166.79
Dipole, Da:	7.47
IP(EA), eV:	-9.35(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N'-diamino-N-[2-(2,4-difluorophenyl)-3,3-difluoro-2-nitroso-3-[5-(pyridin-2-ylmethoxy)pyridin-2-yl]propyl]methanimidamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(COC2=CN=C(C=C2)C(C(CN=CNN)C3=C(C=C(C=C3)F)F)(F)F)F

DOS

IR

Vibrations