Geometry & MOs

Info

ID:	268154
PubChem CID:	103598108
Reduced:	ClO2N4H17C18 (1)
Stoich.:	AB2C4D17E18 (1)
Weight, g/mol:	323.163377
ΔH_f, kcal/mol:	-14.22
Dipole, Da:	6.74
IP(EA), eV:	-8.67(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-cyclopentyloxypyridin-4-yl)methyl]-3-pyridin-2-ylprop-2-enamide

Drug info:

PubChemData

Smile

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C=CC3=CC=CC=N3)Cl

DOS

IR

Vibrations