Geometry & MOs

Info

ID:

168697

PubChem CID:

75004853

Reduced:

ClO14N17C74H92 (1)

Stoich.:

AB14C17D74E92 (1)

Weight, g/mol:

418.081027

ΔHf, kcal/mol:

-441.39

Dipole, Da:

12.07

IP(EA), eV:

 -7.23(-0.59)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-hydroxy-2,2-dimethyl-6-(trifluoromethoxy)-3,4-dihydrochromen-4-yl]pyridine-3-sulfonamide

Drug info:

PubChemData

Smile

CC(C(=O)N)NC(=O)C1CCCN1C(=O)C(CCCN=C(N)N)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC3=CC=C(C=C3)O)NC(=O)C(CO)NC(=O)C(CC4=CC=C(C=C4)O)NC(=O)C(CC5=CC=C(C=C5)Cl)NC(=O)C(CC6=CC7=CC=CC=C7C=C6)NC(=O)C

DOS

IR

Vibrations