Geometry & MOs

Info

ID:	362973
PubChem CID:	127309991
Reduced:	SN3O3C21H25 (1)
Stoich.:	AB3C3D21E25 (1)
Weight, g/mol:	393.241627
ΔH_f, kcal/mol:	-80.69
Dipole, Da:	2.59
IP(EA), eV:	-9.02(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[6-(2,6-dimethylmorpholin-4-yl)pyridin-3-yl]methyl]-2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2CC1CC(=O)N3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

DOS

IR

Vibrations