Geometry & MOs

Info

ID:	413585
PubChem CID:	135086534
Reduced:	OC10H15 (2)
Stoich.:	AB10C15 (2)
Weight, g/mol:	222.129417
ΔH_f, kcal/mol:	-69.16
Dipole, Da:	3.97
IP(EA), eV:	-8.92(0.12)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(1-benzyl-4-fluoro-1,2,3,6-tetrahydropyridin-1-ium-5-yl)methanol

Drug info:

PubChemData

Smile

CC1=C(C(CCC1)(C)C)C/C=C(\C)/C(C#CC(=CCO)C)O

DOS

IR

Vibrations