Geometry & MOs

Info

ID:	446683
PubChem CID:	135276918
Reduced:	O2N5F6C26H29 (1)
Stoich.:	A2B5C6D26E29 (1)
Weight, g/mol:	331.254501
ΔH_f, kcal/mol:	-332.08
Dipole, Da:	3.7
IP(EA), eV:	-9.01(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-pentadecan-8-yl-1,2-thiazolidine 1,1-dioxide

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC[C@]2(CC[C@](CN2)(C/C=N\N=C/N)C(=O)N)C3=CC=CC=C3

DOS

IR

Vibrations