Geometry & MOs

Info

ID:	254456
PubChem CID:	103125428
Reduced:	ON3C11H21 (1)
Stoich.:	AB3C11D21 (1)
Weight, g/mol:	261.041738
ΔH_f, kcal/mol:	-46.67
Dipole, Da:	4.39
IP(EA), eV:	-8.52(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-2-methylpyrazol-3-yl)-pyrazolo[1,5-a]pyrazin-3-ylmethanone

Drug info:

PubChemData

Smile

CC(C)N(C)CCCCN1C=CNC1=O

DOS

IR

Vibrations