Geometry & MOs

Info

ID:

348076

PubChem CID:

127273138

Reduced:

F2O2N4C17H24 (1)

Stoich.:

A2B2C4D17E24 (1)

Weight, g/mol:

388.247441

ΔHf, kcal/mol:

-161.84

Dipole, Da:

7.21

IP(EA), eV:

-8.59(-0.19)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(6-cyclopentyloxypyridin-3-yl)-3-[1-(3-methylbutanoyl)piperidin-4-yl]urea

Drug info:

PubChemData

Smile

C1CCC(C1)OC2=NC=C(C=C2)NC(=O)N3CCN(CC3)CC(F)F

DOS

IR

Vibrations