Geometry & MOs

Info

ID:	283792
PubChem CID:	104008042
Reduced:	O3N4C14H20 (1)
Stoich.:	A3B4C14D20 (1)
Weight, g/mol:	187.120843
ΔH_f, kcal/mol:	-65.2
Dipole, Da:	9.77
IP(EA), eV:	-9.54(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[3-(2-hydroxyethoxy)propyl]but-2-enamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)C(=O)NCCCOCCO)N=N1

DOS

IR

Vibrations