Geometry & MOs

Info

ID:	254484
PubChem CID:	103125613
Reduced:	ON3C11H19 (1)
Stoich.:	AB3C11D19 (1)
Weight, g/mol:	291.061946
ΔH_f, kcal/mol:	-40.82
Dipole, Da:	4.39
IP(EA), eV:	-8.47(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyrazolo[1,5-a]pyridin-3-yl-[4-(trifluoromethyl)pyridin-3-yl]methanone

Drug info:

PubChemData

Smile

CC(CN1CCCC1)CN2C=CNC2=O

DOS

IR

Vibrations