Geometry & MOs

Info

ID:	230458
PubChem CID:	87570950
Reduced:	O9C23H38 (1)
Stoich.:	A9B23C38 (1)
Weight, g/mol:	720.314577
ΔH_f, kcal/mol:	-294.65
Dipole, Da:	1.01
IP(EA), eV:	-9.94(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(/C=C(\C(=O)OOC(OC(=O)OC(OOC(=O)/C(=C\C(CC)(C)C)/C)C)C)/C)(C)C

DOS

IR

Vibrations