Geometry & MOs

Info

ID:	214607
PubChem CID:	85083270
Reduced:	N6O9C25H30 (1)
Stoich.:	A6B9C25D30 (1)
Weight, g/mol:	558.20187
ΔH_f, kcal/mol:	-175.68
Dipole, Da:	5.07
IP(EA), eV:	-9.27(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-dimethoxyphosphoryl-5-hydroxy-1,3,4-tris(phenylmethoxy)pentan-2-yl] formate

Drug info:

PubChemData

Smile

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N(CC3=NN(N=N3)C)C4=C(C=C(C=C4)C(=O)OC)OC)O)C(OC)OC

DOS

IR

Vibrations