Geometry & MOs

Info

ID:	147432
PubChem CID:	53787088
Reduced:	FNC26H28 (1)
Stoich.:	ABC26D28 (1)
Weight, g/mol:	634.722977
ΔH_f, kcal/mol:	5.59
Dipole, Da:	3.78
IP(EA), eV:	-8.72(0.38)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

docosyl-icosyl-dimethylazanium

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2[C@H]([C@H]1NCCCC3=CC=CC=C3)CC4=CC=C(C=C4)F

DOS

IR

Vibrations