Geometry & MOs

Info

ID:	35655
PubChem CID:	7980152
Reduced:	NO7H17C19 (1)
Stoich.:	AB7C17D19 (1)
Weight, g/mol:	408.249846
ΔH_f, kcal/mol:	-217.35
Dipole, Da:	6.96
IP(EA), eV:	-8.91(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-[(3,4-dimethoxyphenyl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)NC(=O)COC(=O)[C@@H]2COC3=CC=CC=C3O2

DOS

IR

Vibrations