Geometry & MOs

Info

ID:	360150
PubChem CID:	127300730
Reduced:	SO2N4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	332.246378
ΔH_f, kcal/mol:	-43.92
Dipole, Da:	5.86
IP(EA), eV:	-8.55(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2-(3-hydroxy-1-adamantyl)acetamide

Drug info:

PubChemData

Smile

C1CCN2CCC(C2C1)NC(=O)C3=CC=C(S3)NC(=O)NC4=CC=CC=C4

DOS

IR

Vibrations