Geometry & MOs

Info

ID:	126687
PubChem CID:	50973197
Reduced:	O2N5C21H27 (1)
Stoich.:	A2B5C21D27 (1)
Weight, g/mol:	318.230728
ΔH_f, kcal/mol:	-20.76
Dipole, Da:	7.45
IP(EA), eV:	-8.16(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide

Drug info:

PubChemData

Smile

CCN1C(=C(C(=N1)C)NC(=O)CN2CCC3=C(C2)C4=C(N3)C=CC(=C4)OC)C

DOS

IR

Vibrations