Geometry & MOs

Info

ID:	254128
PubChem CID:	103122888
Reduced:	BrON3C10H16 (1)
Stoich.:	ABC3D10E16 (1)
Weight, g/mol:	310.04292
ΔH_f, kcal/mol:	-25.27
Dipole, Da:	3.87
IP(EA), eV:	-9.72(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC(CNC(=O)C1=NN(C=C1)C)Br

DOS

IR

Vibrations