Geometry & MOs

Info

ID:	52966
PubChem CID:	14709304
Reduced:	BrNOC14H16 (1)
Stoich.:	ABCD14E16 (1)
Weight, g/mol:	293.04153
ΔH_f, kcal/mol:	-10.24
Dipole, Da:	4.7
IP(EA), eV:	-8.1(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenyl-2-pyridin-1-ium-1-ylpropan-1-ol;bromide

Drug info:

PubChemData

Smile

CC1=C[N+](=CC=C1)CC(C2=CC=CC=C2)O.[Br-]

DOS

IR

Vibrations