Geometry & MOs

Info

ID:	175335
PubChem CID:	75884600
Reduced:	N2O3C21H35 (1)
Stoich.:	A2B3C21D35 (1)
Weight, g/mol:	362.256943
ΔH_f, kcal/mol:	-125.82
Dipole, Da:	4.63
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.176706
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-3,4-diethoxybenzamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C(=O)NCCC[NH+]2CC(CC(C2)C)C)OCC

DOS

IR

Vibrations