Geometry & MOs

Info

ID:	130728
PubChem CID:	51096968
Reduced:	N2O3C14H14 (1)
Stoich.:	A2B3C14D14 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	-33.65
Dipole, Da:	4.12
IP(EA), eV:	-9.04(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyanomethyl)-N-cyclopropyl-2-(4-ethylphenoxy)acetamide

Drug info:

PubChemData

Smile

C1CC1N(CC#N)C(=O)C2COC3=CC=CC=C3O2

DOS

IR

Vibrations