Geometry & MOs

Info

ID:	385136
PubChem CID:	134978392
Reduced:	P3N5C10O14H16 (1)
Stoich.:	A3B5C10D14E16 (1)
Weight, g/mol:	463.176859
ΔH_f, kcal/mol:	-738.73
Dipole, Da:	13.44
IP(EA), eV:	-8.77(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(phenylsulfanyl)phosphinate;dicyclohexylazanium

Drug info:

PubChemData

Smile

C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(OP(=O)(O)O)OP(=O)(O)O)O)O)NC(=NC2=O)N

DOS

IR

Vibrations