Geometry & MOs

Info

ID:	211254
PubChem CID:	80920346
Reduced:	ClO3N4H9C11 (1)
Stoich.:	AB3C4D9E11 (1)
Weight, g/mol:	283.070323
ΔH_f, kcal/mol:	29.86
Dipole, Da:	7.71
IP(EA), eV:	-9.41(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(difluoromethylsulfanyl)phenyl]-2-hydrazinylpyrimidin-4-amine

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])Cl)NN

DOS

IR

Vibrations