Geometry & MOs

Info

ID:	52126
PubChem CID:	12014914
Reduced:	ClPN2O3C9H12 (1)
Stoich.:	ABC2D3E9F12 (1)
Weight, g/mol:	256.002455
ΔH_f, kcal/mol:	-126.66
Dipole, Da:	1.1
IP(EA), eV:	-8.85(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-4-(chloromethyl)-4-sulfanylidene-5H-1,3,4lambda5-thiazaphosphol-2-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N=C(N)OCP(=O)(CCl)O

DOS

IR

Vibrations