Geometry & MOs

Info

ID:	273171
PubChem CID:	103770622
Reduced:	N2O5C12H18 (1)
Stoich.:	A2B5C12D18 (1)
Weight, g/mol:	293.199094
ΔH_f, kcal/mol:	-115.61
Dipole, Da:	2.76
IP(EA), eV:	-10.24(-1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethyl-2-hydroxypentyl)-3-(4-methylphenoxy)propanamide

Drug info:

PubChemData

Smile

CCC(CC)C(CNC(=O)C1=CC=C(O1)[N+](=O)[O-])O

DOS

IR

Vibrations