Geometry & MOs

Info

ID:	348364
PubChem CID:	127273429
Reduced:	O2N5C18H19 (1)
Stoich.:	A2B5C18D19 (1)
Weight, g/mol:	347.232125
ΔH_f, kcal/mol:	-4.51
Dipole, Da:	4.34
IP(EA), eV:	-9.08(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)CN3C=CC(=O)C4=CC=CC=C43

DOS

IR

Vibrations