Geometry & MOs

Info

ID:	55501
PubChem CID:	17395474
Reduced:	N3O3C12H19 (1)
Stoich.:	A3B3C12D19 (1)
Weight, g/mol:	280.121178
ΔH_f, kcal/mol:	-62.95
Dipole, Da:	4.99
IP(EA), eV:	-10.16(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyanophenoxy)-N-methyl-N-phenylpropanamide

Drug info:

PubChemData

Smile

CC(C)CCC(C)NC(=O)C1=CC(=CN1)[N+](=O)[O-]

DOS

IR

Vibrations