Geometry & MOs

Info

ID:	384982
PubChem CID:	134978081
Reduced:	PCl3N5O8C12H13 (1)
Stoich.:	AB3C5D8E12F13 (1)
Weight, g/mol:	305.211981
ΔH_f, kcal/mol:	-351.76
Dipole, Da:	3.6
IP(EA), eV:	-9.28(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexylcyclohexanamine;ethyl(methoxy)phosphinic acid

Drug info:

PubChemData

Smile

C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OC(=O)C(Cl)(Cl)Cl)O)O)N

DOS

IR

Vibrations