Geometry & MOs

Info

ID:	248045
PubChem CID:	103078497
Reduced:	N5C11H21 (1)
Stoich.:	A5B11C21 (1)
Weight, g/mol:	280.03236
ΔH_f, kcal/mol:	41.15
Dipole, Da:	3.35
IP(EA), eV:	-8.0(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(3-bromo-4-methylphenyl)-1-methylpyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CN1CCC(C1)CN(C)C2=NN(C=C2N)C

DOS

IR

Vibrations