Geometry & MOs

Info

ID:	346670
PubChem CID:	127271174
Reduced:	N3C8H11 (2)
Stoich.:	A3B8C11 (2)
Weight, g/mol:	354.253195
ΔH_f, kcal/mol:	97.24
Dipole, Da:	4.58
IP(EA), eV:	-8.6(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclopentylmethyl)piperidin-4-yl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=CN=CC(=N2)N3CCN(CC3)C4CC4)C

DOS

IR

Vibrations