Geometry & MOs

Info

ID:

311317

PubChem CID:

126590416

Reduced:

FSO2N3C22H22 (1)

Stoich.:

ABC2D3E22F22 (1)

Weight, g/mol:

872.41305

ΔHf, kcal/mol:

-50.57

Dipole, Da:

5.92

IP(EA), eV:

-8.61(-0.73)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

9-(2,3-dihydronaphthalen-2-yl)-3-[4-(9-phenyl-4b,7,8,8a-tetrahydrocarbazol-3-yl)phenyl]-6-[(1R)-1,2,2-triphenylethyl]carbazole

Drug info:

PubChemData

Smile

CCC(=O)NC1=CC(=C(C=C1)OC2=C3C(=NC=C2)C=C(S3)C4=CCCN(C4)C)F

DOS

IR

Vibrations