Geometry & MOs

Info

ID:

320760

PubChem CID:

126663250

Reduced:

NO2P3C10H16 (1)

Stoich.:

AB2C3D10E16 (1)

Weight, g/mol:

709.295907

ΔHf, kcal/mol:

-79.04

Dipole, Da:

2.5

IP(EA), eV:

 -9.02(0.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[2-(1-hydroxypropan-2-yloxy)-2-methoxyethyl] 5-[4-[3-(6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl)phenoxy]carbonyloxybutylamino]-5-oxopentanoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC(C(=O)OP)N(P)P

DOS

IR

Vibrations