Geometry & MOs

Info

ID:	147862
PubChem CID:	53787520
Reduced:	SO4C10H12 (1)
Stoich.:	AB4C10D12 (1)
Weight, g/mol:	410.164696
ΔH_f, kcal/mol:	-125.37
Dipole, Da:	5.95
IP(EA), eV:	-9.6(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,4-di(propan-2-yl)phenyl] diphenyl phosphate

Drug info:

PubChemData

Smile

CC(=C)C(=O)OCCC(=S)C(=C)C(=O)O

DOS

IR

Vibrations