Geometry & MOs

Info

ID:	42915
PubChem CID:	10317124
Reduced:	NO5C21H25 (1)
Stoich.:	AB5C21D25 (1)
Weight, g/mol:	371.184506
ΔH_f, kcal/mol:	-197.36
Dipole, Da:	2.57
IP(EA), eV:	-8.61(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethoxyphenyl)-2-[4-(1-oxidopyridin-1-ium-2-yl)piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CCC(CC1)COC(=O)C2=C(C=CC(=C2)NCC3=C(C=CC(=C3)O)O)O

DOS

IR

Vibrations