Geometry & MOs

Info

ID:	372082
PubChem CID:	131293020
Reduced:	NC3H5 (4)
Stoich.:	AB3C5 (4)
Weight, g/mol:	225.046903
ΔH_f, kcal/mol:	20.87
Dipole, Da:	1.51
IP(EA), eV:	-8.31(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-5-fluoro-2-(5-methylpyrazol-1-yl)aniline

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1C(C)C)N2CCNCC2

DOS

IR

Vibrations