Geometry & MOs

Info

ID:	52972
PubChem CID:	14709314
Reduced:	BrNC14H14 (1)
Stoich.:	ABC14D14 (1)
Weight, g/mol:	295.061136
ΔH_f, kcal/mol:	51.03
Dipole, Da:	6.21
IP(EA), eV:	-7.93(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[(E)-2-phenylethenyl]pyridin-1-ium;perchlorate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations