Geometry & MOs

Info

ID:	394942
PubChem CID:	135024197
Reduced:	NOC12H18 (2)
Stoich.:	ABC12D18 (2)
Weight, g/mol:	289.134088
ΔH_f, kcal/mol:	-51.06
Dipole, Da:	4.27
IP(EA), eV:	-8.53(0.44)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-(4-methyl-2-phenylpyridin-1-ium-1-yl)benzamide

Drug info:

PubChemData

Smile

CCOCCN(CCN(CCOCC)CC1=CC=CC=C1)CC2=CC=CC=C2

DOS

IR

Vibrations