Geometry & MOs

Info

ID:	172678
PubChem CID:	75539876
Reduced:	ClN2O4C17H21 (1)
Stoich.:	AB2C4D17E21 (1)
Weight, g/mol:	260.061949
ΔH_f, kcal/mol:	-129.41
Dipole, Da:	2.62
IP(EA), eV:	-8.94(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-methoxypyridin-3-yl)-3-thiophen-3-ylprop-2-enamide

Drug info:

PubChemData

Smile

C1COCCN1CCNC(=O)C=CC2=CC3=C(C(=C2)Cl)OCCO3

DOS

IR

Vibrations