Geometry & MOs

Info

ID:	254184
PubChem CID:	103123278
Reduced:	O3N6C12H16 (1)
Stoich.:	A3B6C12D16 (1)
Weight, g/mol:	201.053826
ΔH_f, kcal/mol:	10.0
Dipole, Da:	4.69
IP(EA), eV:	-9.36(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-pyrazolo[1,5-a]pyrazin-3-ylprop-2-ynoate

Drug info:

PubChemData

Smile

CC1=NON=C1CN2C(=C(N=N2)C(=O)O)C3CCNCC3

DOS

IR

Vibrations