Geometry & MOs

Info

ID:	149359
PubChem CID:	53789031
Reduced:	O3N4C18H20 (1)
Stoich.:	A3B4C18D20 (1)
Weight, g/mol:	304.053432
ΔH_f, kcal/mol:	-54.33
Dipole, Da:	7.59
IP(EA), eV:	-8.79(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1,3-dioxolan-2-yl)phenoxy]-hydroxy-propoxy-sulfanylidene-lambda5-phosphane

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN=C2C(=NNC3=CC=CC=C3)CCC(N2C1=O)C

DOS

IR

Vibrations