Geometry & MOs

Info

ID:	247968
PubChem CID:	103077810
Reduced:	N2C8H9 (2)
Stoich.:	A2B8C9 (2)
Weight, g/mol:	291.125073
ΔH_f, kcal/mol:	86.43
Dipole, Da:	2.48
IP(EA), eV:	-7.89(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3-chlorophenyl)piperazin-1-yl]-1-methylpyrazol-4-amine

Drug info:

PubChemData

Smile

CCN(C1=CC=CC2=CC=CC=C21)C3=NN(C=C3N)C

DOS

IR

Vibrations