Geometry & MOs

Info

ID:	254466
PubChem CID:	103125510
Reduced:	FON2H15C17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	279.100777
ΔH_f, kcal/mol:	-9.49
Dipole, Da:	6.21
IP(EA), eV:	-9.05(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-cyclopropyloxyphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanone

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)CC(=O)C2=NN(C3=CC=CC=C32)C

DOS

IR

Vibrations