Geometry & MOs

Info

ID:	253688
PubChem CID:	103120036
Reduced:	ON2C5H5 (2)
Stoich.:	AB2C5D5 (2)
Weight, g/mol:	236.046489
ΔH_f, kcal/mol:	29.41
Dipole, Da:	3.42
IP(EA), eV:	-9.4(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloroprop-2-enyl)pyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(OC1)C(=O)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations