Geometry & MOs

Info

ID:

427319

PubChem CID:

135157069

Reduced:

ClO7N8C43H45 (1)

Stoich.:

AB7C8D43E45 (1)

Weight, g/mol:

693.249786

ΔHf, kcal/mol:

-163.92

Dipole, Da:

13.3

IP(EA), eV:

 -8.34(-1.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[3-[3-[4-[2-fluoro-4-[[1-[(4-fluorophenyl)carbamoyl]cyclopropanecarbonyl]amino]phenoxy]-6-methoxyquinolin-7-yl]oxypropoxy]propoxy]propanoic acid

Drug info:

PubChemData

Smile

C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C=C(C=C3)OCCOCCOCCN4CCN(CC4)CC5=CC=C(C=C5)C6=CC7=C(N6)N=CN=C7NCC8=CC=CC=C8Cl

DOS

IR

Vibrations