Geometry & MOs

Info

ID:	230098
PubChem CID:	87570164
Reduced:	ClSF3N3O4H19C20 (1)
Stoich.:	ABC3D3E4F19G20 (1)
Weight, g/mol:	800.52673
ΔH_f, kcal/mol:	-250.66
Dipole, Da:	7.59
IP(EA), eV:	-9.38(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-[2-(3,4-didodecoxyphenyl)-1,3-dithian-2-yl]methanol

Drug info:

PubChemData

Smile

C1CN(CCN1C(C=O)NC(=O)C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

DOS

IR

Vibrations