Geometry & MOs

Info

ID:	437313
PubChem CID:	135223216
Reduced:	NOC13H17 (1)
Stoich.:	ABC13D17 (1)
Weight, g/mol:	247.120843
ΔH_f, kcal/mol:	-29.45
Dipole, Da:	3.93
IP(EA), eV:	-9.53(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[2-(2-methylprop-2-enoylamino)ethyl]phenyl] acetate

Drug info:

PubChemData

Smile

CCCC(=CCC1=CC=CC=C1)C(=O)N

DOS

IR

Vibrations