Geometry & MOs

Info

ID:	51269
PubChem CID:	12013913
Reduced:	O3N4H24C34 (1)
Stoich.:	A3B4C24D34 (1)
Weight, g/mol:	522.205576
ΔH_f, kcal/mol:	85.91
Dipole, Da:	6.28
IP(EA), eV:	-9.07(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(4-methoxyphenyl)diazenyl]-3,5-diphenylpyrazol-1-yl]-2-naphthalen-1-ylethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(C(=NN2C(=O)CC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5)N=NC6=CC=C(C=C6)C(=O)O

DOS

IR

Vibrations