Geometry & MOs

Info

ID:	209716
PubChem CID:	80708207
Reduced:	NSO3C7H17 (1)
Stoich.:	ABC3D7E17 (1)
Weight, g/mol:	256.157563
ΔH_f, kcal/mol:	-146.49
Dipole, Da:	6.45
IP(EA), eV:	-9.46(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methoxyphenyl)-N-[(5-methylpyridin-2-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC(C)OCCN(C)S(=O)(=O)C

DOS

IR

Vibrations