Geometry & MOs

Info

ID:	401682
PubChem CID:	135052133
Reduced:	SN2O2H13C14 (2)
Stoich.:	AB2C2D13E14 (2)
Weight, g/mol:	408.14098
ΔH_f, kcal/mol:	-9.73
Dipole, Da:	9.62
IP(EA), eV:	-8.8(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[chloro(triphenyl)-lambda5-phosphanyl]-4,4-dimethylpent-1-en-3-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N/N=C(\C(=N/NS(=O)(=O)C2=CC=C(C=C2)C)\C3=CC=CC=C3)/C4=CC=CC=C4

DOS

IR

Vibrations