Geometry & MOs

Info

ID:	368415
PubChem CID:	127328340
Reduced:	ON5C14H23 (1)
Stoich.:	AB5C14D23 (1)
Weight, g/mol:	383.19574
ΔH_f, kcal/mol:	-20.91
Dipole, Da:	7.47
IP(EA), eV:	-9.4(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN=C2N1CC(CC2)CNC(=O)C3CCCN3C

DOS

IR

Vibrations