Geometry & MOs

Info

ID:	372461
PubChem CID:	131298032
Reduced:	ClO2N3C10H10 (1)
Stoich.:	AB2C3D10E10 (1)
Weight, g/mol:	217.121512
ΔH_f, kcal/mol:	-28.58
Dipole, Da:	2.38
IP(EA), eV:	-9.31(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-ethylphenoxy)-1-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

CN1C2=NC=C(C(=C2C=N1)Cl)CC(=O)OC

DOS

IR

Vibrations