Geometry & MOs

Info

ID:

188628

PubChem CID:

77745003

Reduced:

FCl2O3N5C31H38 (1)

Stoich.:

AB2C3D5E31F38 (1)

Weight, g/mol:

587.223009

ΔHf, kcal/mol:

-157.72

Dipole, Da:

3.05

IP(EA), eV:

 -9.28(-0.61)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-chloro-6'-(3-chlorophenyl)-5-fluoro-2',2',16'-trimethylspiro[1H-indole-3,5'-9,13,16,18-tetrazatricyclo[11.3.1.14,7]octadecane]-2,8'-dione

Drug info:

PubChemData

Smile

CCN(CC)C(=O)N1CC(C1)NC(=O)C2C(C3(C(N2)CC(C)(C)C)C4=C(C=C(C=C4)Cl)NC3=O)C5=C(C(=CC=C5)Cl)F

DOS

IR

Vibrations