Geometry & MOs

Info

ID:	78363
PubChem CID:	49689088
Reduced:	N2O5C23H28 (1)
Stoich.:	A2B5C23D28 (1)
Weight, g/mol:	412.199822
ΔH_f, kcal/mol:	-169.63
Dipole, Da:	7.06
IP(EA), eV:	-8.57(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl 4-[[[2-(4-ethoxyphenoxy)acetyl]amino]methyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CC(=O)NCC2CCN(CC2)C(=O)OC3=CC=CC=C3)OC

DOS

IR

Vibrations