Geometry & MOs

Info

ID:	230227
PubChem CID:	87570468
Reduced:	F2S2N3O4C25H25 (1)
Stoich.:	A2B2C3D4E25F25 (1)
Weight, g/mol:	1304.503953
ΔH_f, kcal/mol:	-155.45
Dipole, Da:	6.39
IP(EA), eV:	-8.16(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2,4-bis(oxiran-2-ylmethoxy)-6-[3,5,7-tris[2,3,5-tris(oxiran-2-ylmethoxy)phenyl]-1-adamantyl]phenoxy]methyl]oxirane

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=CN=C(S2)NC(=O)C(C3=CC=C(C=C3)S(=O)(=O)C4CC4)OC5=C(C=C(C=C5)F)F

DOS

IR

Vibrations