Geometry & MOs

Info

ID:	138449
PubChem CID:	52368577
Reduced:	N2O2C17H22 (1)
Stoich.:	A2B2C17D22 (1)
Weight, g/mol:	390.275667
ΔH_f, kcal/mol:	8.25
Dipole, Da:	4.81
IP(EA), eV:	-8.44(0.46)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-[2-[[2-methyl-2-[(3R)-3-methylpiperidin-1-ium-1-yl]propyl]amino]-2-oxoethyl]-4-propan-2-yloxybenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CN(CC=C)CC2=CC=C(C=C2)OC

DOS

IR

Vibrations