Geometry & MOs

Info

ID:

313099

PubChem CID:

126611899

Reduced:

ClON4C27H27 (1)

Stoich.:

ABC4D27E27 (1)

Weight, g/mol:

550.158325

ΔHf, kcal/mol:

33.55

Dipole, Da:

6.4

IP(EA), eV:

 -9.2(-0.87)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(E)-3-(6-aminopyridin-3-yl)-N-[[5-[3-chloro-6-(4,4-difluoropiperidine-1-carbonyl)naphthalen-2-yl]furan-2-yl]methyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1CC[C@@H]([C@H](C1)C2=CC=CC=C2Cl)NC(=O)C3=CC4=C(C=C3)NN=C4C5=CC(=NC=C5)C

DOS

IR

Vibrations