Geometry & MOs

Info

ID:	254094
PubChem CID:	103122650
Reduced:	ClON3C14H18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	282.01162
ΔH_f, kcal/mol:	-14.17
Dipole, Da:	4.26
IP(EA), eV:	-9.29(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(CCCl)CNC(=O)C1=C2C=CC=CN2N=C1

DOS

IR

Vibrations