Geometry & MOs

Info

ID:	366391
PubChem CID:	127319872
Reduced:	SN2O4C16H22 (1)
Stoich.:	AB2C4D16E22 (1)
Weight, g/mol:	249.172879
ΔH_f, kcal/mol:	-130.28
Dipole, Da:	7.9
IP(EA), eV:	-9.12(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-adamantyl-(3-methoxyazetidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N3CC(C3)OC

DOS

IR

Vibrations