Geometry & MOs

Info

ID:	248019
PubChem CID:	103078242
Reduced:	N4C13H18 (1)
Stoich.:	A4B13C18 (1)
Weight, g/mol:	296.02727
ΔH_f, kcal/mol:	55.92
Dipole, Da:	1.62
IP(EA), eV:	-7.69(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(5-bromo-2-methoxyphenyl)-1-methylpyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C)NC2=NN(C=C2N)C

DOS

IR

Vibrations