Geometry & MOs

Info

ID:	211218
PubChem CID:	80912134
Reduced:	BrN7C13H18 (1)
Stoich.:	AB7C13D18 (1)
Weight, g/mol:	346.029
ΔH_f, kcal/mol:	79.97
Dipole, Da:	3.54
IP(EA), eV:	-8.86(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromophenyl)-4-hydrazinyl-6-pyrazol-1-yl-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CCN(CC)C1=NC(=NC(=N1)NN)NC2=CC=C(C=C2)Br

DOS

IR

Vibrations