Geometry & MOs

Info

ID:	230412
PubChem CID:	87570824
Reduced:	N2F4O8C21H26 (1)
Stoich.:	A2B4C8D21E26 (1)
Weight, g/mol:	491.517849
ΔH_f, kcal/mol:	-502.43
Dipole, Da:	7.16
IP(EA), eV:	-8.77(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-(4-methylpentan-2-ylideneamino)-N-[10-(4-methylpentan-2-ylideneamino)decan-3-yl]decan-3-amine

Drug info:

PubChemData

Smile

CC(C)N1C(=C(C(=N1)O[C@]2([C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)CC3=CC(=C(C=C3)OC)F)C(F)(F)F

DOS

IR

Vibrations