Geometry & MOs

Info

ID:	180826
PubChem CID:	76691414
Reduced:	O3C12H20 (1)
Stoich.:	A3B12C20 (1)
Weight, g/mol:	342.170844
ΔH_f, kcal/mol:	-108.44
Dipole, Da:	2.12
IP(EA), eV:	-9.27(1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-isocyanoethoxy-[(1-methyl-6-methylidene-2,5-dioxabicyclo[2.2.1]heptan-7-yl)oxy]phosphanyl]-N-propan-2-ylpropan-2-amine

Drug info:

PubChemData

Smile

CCC12C(C(CO1)OC23CC3(C)C)OC

DOS

IR

Vibrations