Geometry & MOs

Info

ID:	253329
PubChem CID:	103117749
Reduced:	ON5C14H15 (1)
Stoich.:	AB5C14D15 (1)
Weight, g/mol:	283.14331
ΔH_f, kcal/mol:	49.66
Dipole, Da:	5.91
IP(EA), eV:	-9.74(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanocycloheptyl)pyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(C#N)NC(=O)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations