Geometry & MOs

Info

ID:

167461

PubChem CID:

74831463

Reduced:

Cl2O3N6H30C31 (1)

Stoich.:

A2B3C6D30E31 (1)

Weight, g/mol:

548.334918

ΔHf, kcal/mol:

-17.95

Dipole, Da:

7.05

IP(EA), eV:

 -9.39(-1.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl (6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-yl) carbonate

Drug info:

PubChemData

Smile

CC1(CCN(C1)C(=O)C2(CC2)NC(=O)C3=CN=C4N3C(C(=O)N4C5=CC(=CC(=C5)Cl)Cl)(C)CC6=CC=C(C=C6)C#N)C

DOS

IR

Vibrations