Geometry & MOs

Info

ID:

47129

PubChem CID:

10529794

Reduced:

NPSiO5C27H36 (1)

Stoich.:

ABCD5E27F36 (1)

Weight, g/mol:

513.229742

ΔHf, kcal/mol:

-244.35

Dipole, Da:

3.01

IP(EA), eV:

 -9.14(-0.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

prop-2-enyl (15S,19S)-15-ethyl-4-(3-methoxypropylsulfamoyl)-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2(7),3,5,8(18),16-pentaene-17-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OC3=CC=CC(=C3)C(OCCN)P(=O)(OC)OC

DOS

IR

Vibrations