Geometry & MOs

Info

ID:	177898
PubChem CID:	76250416
Reduced:	ON5C21H27 (1)
Stoich.:	AB5C21D27 (1)
Weight, g/mol:	355.189592
ΔH_f, kcal/mol:	25.01
Dipole, Da:	7.6
IP(EA), eV:	-8.34(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[6-(dimethylamino)pyridin-3-yl]methyl]-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide

Drug info:

PubChemData

Smile

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)NCC2=CN=C(C=C2)N(C)C)C

DOS

IR

Vibrations