Geometry & MOs

Info

ID:	248129
PubChem CID:	103079121
Reduced:	ClON3C12H14 (1)
Stoich.:	ABC3D12E14 (1)
Weight, g/mol:	273.06689
ΔH_f, kcal/mol:	10.39
Dipole, Da:	4.2
IP(EA), eV:	-8.56(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chloronaphthalen-1-yl)oxy-1-methylpyrazol-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Cl)C)OC2=NN(C=C2N)C

DOS

IR

Vibrations