Geometry & MOs

Info

ID:

191131

PubChem CID:

78108430

Reduced:

N3O4H23C27 (1)

Stoich.:

A3B4C23D27 (1)

Weight, g/mol:

926.422899

ΔHf, kcal/mol:

-38.87

Dipole, Da:

3.0

IP(EA), eV:

 -9.77(-0.94)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

diphenyl-[3-propan-2-yl-2-[[4,4,8,8-tetrakis(3,5-dimethylphenyl)-2,2-dimethyl-3a,8a-dihydro-[1,3]dioxolo[4,5-e][1,3,2]dioxaphosphepin-6-yl]oxy]phenyl]phosphane

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N2C(=O)C(OC2=O)(CC3=CC=CC=C3)C4=NN=C(O4)CC5=CC=CC=C5

DOS

IR

Vibrations