Geometry & MOs

Info

ID:	391255
PubChem CID:	135003908
Reduced:	NWO3C17H23 (1)
Stoich.:	ABC3D17E23 (1)
Weight, g/mol:	435.14554
ΔH_f, kcal/mol:	119.87
Dipole, Da:	3.79
IP(EA), eV:	-6.46(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-adamantyl)-3-phenyl-5,5-bis(trifluoromethyl)-1,2-thiazolidine

Drug info:

PubChemData

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CC1=C(C[C@H]([C@@H](C1)C(=[W])OC)C2=CC=CO2)N3CCOCC3

DOS

IR

Vibrations