Geometry & MOs

Info

ID:	129260
PubChem CID:	51072084
Reduced:	ClNO2C14H16 (1)
Stoich.:	ABC2D14E16 (1)
Weight, g/mol:	303.109173
ΔH_f, kcal/mol:	-90.5
Dipole, Da:	5.78
IP(EA), eV:	-8.74(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

di(propan-2-yloxy)-sulfanylidene-sulfido-lambda5-phosphane;2-hydroxyethyl(dimethyl)azanium

Drug info:

PubChemData

Smile

CC1=[NH+]C(=C(C=C1)O)CCC2=CC=C(C=C2)O.[Cl-]

DOS

IR

Vibrations