Geometry & MOs

Info

ID:	174978
PubChem CID:	75840879
Reduced:	N3O4C19H27 (1)
Stoich.:	A3B4C19D27 (1)
Weight, g/mol:	378.239282
ΔH_f, kcal/mol:	-128.21
Dipole, Da:	8.72
IP(EA), eV:	-8.6(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[[3-methoxy-2-(2-morpholin-4-ylethoxy)phenyl]methyl]piperidin-1-ium-3-carboxamide

Drug info:

PubChemData

Smile

C1CC1C[NH+]2CCN(CC2CCO)C(=O)C3=CC(=CC=C3)NCC(=O)[O-]

DOS

IR

Vibrations