Geometry & MOs

Info

ID:	15210
PubChem CID:	433476
Reduced:	PCl2N2O5C10H21 (1)
Stoich.:	AB2C2D5E10F21 (1)
Weight, g/mol:	350.056514
ΔH_f, kcal/mol:	-203.95
Dipole, Da:	1.75
IP(EA), eV:	-6.75(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

1,4-bis(2-chloroethyl)-1,4-diazoniabicyclo[2.2.1]heptane;phosphonoformic acid

Drug info:

PubChemData

Smile

C1C[N+]2(CC[N+]1(C2)CCCl)CCCl.C(=O)(O)P(=O)(O)O

DOS

IR

Vibrations