Geometry & MOs

Info

ID:	404257
PubChem CID:	135065622
Reduced:	BrN2H15C21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	356.152478
ΔH_f, kcal/mol:	122.01
Dipole, Da:	1.67
IP(EA), eV:	-8.74(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dimethoxyphenyl)-3,4-diphenylpyrazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CN(N=C2C3=CC=CC=C3)C4=CC=C(C=C4)Br

DOS

IR

Vibrations