Geometry & MOs

Info

ID:	364194
PubChem CID:	127314497
Reduced:	ON6C11H14 (1)
Stoich.:	AB6C11D14 (1)
Weight, g/mol:	324.133474
ΔH_f, kcal/mol:	25.08
Dipole, Da:	4.56
IP(EA), eV:	-9.87(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC=C(N1)C(=O)NC2CCC3=NC=NN3C2

DOS

IR

Vibrations