Geometry & MOs

Info

ID:	52973
PubChem CID:	14709316
Reduced:	ClNO4C14H14 (1)
Stoich.:	ABC4D14E14 (1)
Weight, g/mol:	295.061136
ΔH_f, kcal/mol:	61.57
Dipole, Da:	11.58
IP(EA), eV:	-9.62(-2.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=[N+]1/C=C/C2=CC=CC=C2.[O-]Cl(=O)(=O)=O

DOS

IR

Vibrations