Geometry & MOs

Info

ID:	53667
PubChem CID:	14717706
Reduced:	NO3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	225.100108
ΔH_f, kcal/mol:	-121.72
Dipole, Da:	3.08
IP(EA), eV:	-8.51(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]propanamide

Drug info:

PubChemData

Smile

CCC(=O)NCCC1=CC(=C(C=C1)O)OC

DOS

IR

Vibrations