Geometry & MOs

Info

ID:	46277
PubChem CID:	10523676
Reduced:	OP2C11H23 (1)
Stoich.:	AB2C11D23 (1)
Weight, g/mol:	378.129569
ΔH_f, kcal/mol:	-82.41
Dipole, Da:	3.19
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.755360
Charge, e:	0

Chem-info

IUPAC name:

[(E)-3-(dimethylamino)-2-(4-methoxyphenyl)prop-2-enylidene]-dimethylazanium;hexafluorophosphate

Drug info:

PubChemData

Smile

C1CC[P+]2(CCCCP(C1)CCC2)O

DOS

IR

Vibrations