Geometry & MOs

Info

ID:

47092

PubChem CID:

10529523

Reduced:

SiN4C32H36 (1)

Stoich.:

AB4C32D36 (1)

Weight, g/mol:

504.327101

ΔHf, kcal/mol:

68.21

Dipole, Da:

3.51

IP(EA), eV:

 -7.45(0.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

diethyl (2E,4Z,7E)-5-[(1R,3aR,4S,7aR)-4-[tert-butyl(dimethyl)silyl]oxy-7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-1-yl]nona-2,4,7-trienedioate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=C(N([Si]2(C)C)C3=CC=C(C=C3)C)N(C)C4=CC=CC=C4)N(C)C5=CC=CC=C5

DOS

IR

Vibrations