Geometry & MOs

Info

ID:	248711
PubChem CID:	103083845
Reduced:	BrN4C14H17 (1)
Stoich.:	AB4C14D17 (1)
Weight, g/mol:	310.02294
ΔH_f, kcal/mol:	55.81
Dipole, Da:	3.48
IP(EA), eV:	-9.43(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-bromo-2-methylphenyl)-5-fluoro-6-methylpyrimidin-4-yl]hydrazine

Drug info:

PubChemData

Smile

CCCC1=CC(=NC(=N1)C2=C(C=C(C=C2)Br)C)NN

DOS

IR

Vibrations