Geometry & MOs

Info

ID:	348309
PubChem CID:	127273374
Reduced:	OF3N4C20H23 (1)
Stoich.:	AB3C4D20E23 (1)
Weight, g/mol:	335.17461
ΔH_f, kcal/mol:	-161.28
Dipole, Da:	3.44
IP(EA), eV:	-9.66(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3(CCCC3)C4=CC(=CC=C4)C(F)(F)F

DOS

IR

Vibrations