Geometry & MOs

Info

ID:	30007
PubChem CID:	838860
Reduced:	SN2O2C17H18 (1)
Stoich.:	AB2C2D17E18 (1)
Weight, g/mol:	272.116092
ΔH_f, kcal/mol:	0.74
Dipole, Da:	3.32
IP(EA), eV:	-8.51(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxyphenoxy)-N-(pyridin-4-ylmethyl)acetamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)[C@H]2NN=C(S2)CC3=CC=CC=C3)OC

DOS

IR

Vibrations