Geometry & MOs

Info

ID:

65744

PubChem CID:

46386817

Reduced:

ClO3N4H15C17 (1)

Stoich.:

AB3C4D15E17 (1)

Weight, g/mol:

380.084017

ΔHf, kcal/mol:

-61.03

Dipole, Da:

0.74

IP(EA), eV:

-8.76(-0.86)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-3-(5-fluoro-2-pyridin-4-yl-1H-indol-3-yl)urea

Drug info:

PubChemData

Smile

COC(=O)CNC(=O)NC1=C(NC2=C1C=C(C=C2)Cl)C3=CC=NC=C3

DOS

IR

Vibrations