Geometry & MOs

Info

ID:	436744
PubChem CID:	135210106
Reduced:	O5N8C41H48 (1)
Stoich.:	A5B8C41D48 (1)
Weight, g/mol:	550.258944
ΔH_f, kcal/mol:	-95.21
Dipole, Da:	7.29
IP(EA), eV:	-8.61(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,7,8-tris(diethoxyphosphoryl)decane

Drug info:

PubChemData

Smile

CC1(CC2=C(C1)N3CCN(C(=O)C3=C2)C4=NC=CC(=C4CO)C5=C6C(=NN(C6=NC=C5)CC7=CC=C(C=C7)OC)N[C@@H]8CCN(C8)C(=O)OC(C)(C)C)C

DOS

IR

Vibrations