Geometry & MOs

Info

ID:	348378
PubChem CID:	127273443
Reduced:	SO3N4C14H22 (1)
Stoich.:	AB3C4D14E22 (1)
Weight, g/mol:	371.177982
ΔH_f, kcal/mol:	-109.74
Dipole, Da:	4.89
IP(EA), eV:	-9.39(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-4-(thiomorpholin-4-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3(CCCC3)S(=O)(=O)C

DOS

IR

Vibrations