Geometry & MOs

Info

ID:	214289
PubChem CID:	84974932
Reduced:	NOC10H12 (2)
Stoich.:	ABC10D12 (2)
Weight, g/mol:	334.176681
ΔH_f, kcal/mol:	-30.19
Dipole, Da:	3.24
IP(EA), eV:	-8.15(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl]piperidin-1-ium-3-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C=CC(=O)NCC2=CC=C(C=C2)N(C)C

DOS

IR

Vibrations