Geometry & MOs

Info

ID:	294022
PubChem CID:	117422409
Reduced:	NS2C14H21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	267.057468
ΔH_f, kcal/mol:	4.29
Dipole, Da:	1.52
IP(EA), eV:	-8.4(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-1H-pyrazol-3-amine

Drug info:

PubChemData

Smile

CSC1=C(C=C(C=C1)C2(CCCCC2)N)SC

DOS

IR

Vibrations