Geometry & MOs

Info

ID:	444657
PubChem CID:	135263155
Reduced:	O2N3C10H19 (1)
Stoich.:	A2B3C10D19 (1)
Weight, g/mol:	314.199428
ΔH_f, kcal/mol:	-72.78
Dipole, Da:	7.61
IP(EA), eV:	-8.88(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-methoxy-2-(4-methylpiperidin-1-yl)phenyl]-(5-methylfuran-2-yl)methanamine

Drug info:

PubChemData

Smile

CC(=O)[O-].CN1CCC[NH+]2C1=NCCC2

DOS

IR

Vibrations