Geometry & MOs

Info

ID:	211100
PubChem CID:	80896997
Reduced:	ClFN5C13H15 (1)
Stoich.:	ABC5D13E15 (1)
Weight, g/mol:	335.07456
ΔH_f, kcal/mol:	14.84
Dipole, Da:	3.41
IP(EA), eV:	-8.94(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-bromophenyl)ethyl]-5-ethyl-6-hydrazinylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC(C)C1=C(N=CN=C1NN)NC2=CC(=C(C=C2)Cl)F

DOS

IR

Vibrations