Geometry & MOs

Info

ID:	348361
PubChem CID:	127273426
Reduced:	SO2N5C18H23 (1)
Stoich.:	AB2C5D18E23 (1)
Weight, g/mol:	354.205576
ΔH_f, kcal/mol:	-30.42
Dipole, Da:	3.88
IP(EA), eV:	-8.97(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3CCCN3C(=O)CC4=CC=CS4

DOS

IR

Vibrations