Geometry & MOs

Info

ID:	312838
PubChem CID:	126609105
Reduced:	SH3C4 (4)
Stoich.:	AB3C4 (4)
Weight, g/mol:	165.139174
ΔH_f, kcal/mol:	75.85
Dipole, Da:	0.9
IP(EA), eV:	-8.25(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-(3-propylpyridin-1-ium-1-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=CC2C(S1)C3=C(S2)C4=C(C=C3)C5=C(S4)C=C(S5)C

DOS

IR

Vibrations