Geometry & MOs

Info

ID:	254765
PubChem CID:	103127506
Reduced:	ClN5C14H16 (1)
Stoich.:	AB5C14D16 (1)
Weight, g/mol:	301.136117
ΔH_f, kcal/mol:	84.41
Dipole, Da:	4.84
IP(EA), eV:	-8.82(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-methyl-1,3-thiazol-4-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=NN(C(=C1Cl)CC(C2=C3C=CC=CN3N=C2)N)C

DOS

IR

Vibrations