Geometry & MOs

Info

ID:	273181
PubChem CID:	103770642
Reduced:	NO3C10H21 (1)
Stoich.:	AB3C10D21 (1)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	-174.42
Dipole, Da:	1.44
IP(EA), eV:	-9.9(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(3-ethyl-2-hydroxypentyl)-3-phenylprop-2-enamide

Drug info:

PubChemData

Smile

CCC(CC)C(CNC(=O)OCC)O

DOS

IR

Vibrations