Geometry & MOs

Info

ID:	47262
PubChem CID:	10531012
Reduced:	PN3O5C27H53 (1)
Stoich.:	AB3C5D27E53 (1)
Weight, g/mol:	440.233927
ΔH_f, kcal/mol:	-258.28
Dipole, Da:	11.61
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.879405
Charge, e:	1

Chem-info

IUPAC name:

benzyl-dimethyl-(tributylstannylmethyl)azanium

Drug info:

PubChemData

Smile

CCCC[P+](CCCC)(CCCC)CC1=COC(=N1)CCCNC(=O)[C@H]([C@H]([C@H](COC)N(C)C)O)O

DOS

IR

Vibrations