Geometry & MOs

Info

ID:	389237
PubChem CID:	134991779
Reduced:	NO6C21H33 (1)
Stoich.:	AB6C21D33 (1)
Weight, g/mol:	364.394326
ΔH_f, kcal/mol:	-273.88
Dipole, Da:	3.88
IP(EA), eV:	-8.12(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

methyl-[(2-methylcyclohexen-1-yl)methyl]-dioctylazanium

Drug info:

PubChemData

Smile

CC(C)(C)C1=C/C(=C/N[C@@H]2[C@H]([C@H]([C@H](O[C@H]2O)CO)O)O)/C(=O)C(=C1)C(C)(C)C

DOS

IR

Vibrations