Geometry & MOs

Info

ID:	248062
PubChem CID:	103078615
Reduced:	ON4C11H20 (1)
Stoich.:	AB4C11D20 (1)
Weight, g/mol:	294.04801
ΔH_f, kcal/mol:	-23.73
Dipole, Da:	3.24
IP(EA), eV:	-7.75(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(4-bromo-2,6-dimethylphenyl)-1-methylpyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)NCC2(CCCCC2)O)N

DOS

IR

Vibrations