Geometry & MOs

Info

ID:	320546
PubChem CID:	126661717
Reduced:	O2C23H28 (1)
Stoich.:	A2B23C28 (1)
Weight, g/mol:	355.205991
ΔH_f, kcal/mol:	-58.72
Dipole, Da:	3.04
IP(EA), eV:	-8.73(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[5-fluoro-2-methyl-3-[6-(methylamino)pyridin-3-yl]phenyl]-2-methyl-N-propylbut-2-enamide

Drug info:

PubChemData

Smile

CCC(C)C/C(=C\C1=C(C(=CC=C1)C2=CC=C(C=C2)OC)C)/C(=O)C

DOS

IR

Vibrations