Geometry & MOs

Info

ID:	294925
PubChem CID:	117505499
Reduced:	ClO2N3C16H20 (1)
Stoich.:	AB2C3D16E20 (1)
Weight, g/mol:	321.124405
ΔH_f, kcal/mol:	-33.23
Dipole, Da:	4.01
IP(EA), eV:	-8.12(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-chloro-5-cyclopentyloxy-4-methoxyphenyl)-2-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

CN1C(=C(C=N1)C2=CC(=C(C=C2Cl)OC3CCCC3)OC)N

DOS

IR

Vibrations