Geometry & MOs

Info

ID:	401526
PubChem CID:	135051520
Reduced:	N2S2C17H18 (1)
Stoich.:	A2B2C17D18 (1)
Weight, g/mol:	226.096283
ΔH_f, kcal/mol:	68.57
Dipole, Da:	3.36
IP(EA), eV:	-8.53(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dideuterio-1,3-diphenylpropane-1,3-dione

Drug info:

PubChemData

Smile

CCC(C(=S)NC1=CC=CC=C1)C(=S)NC2=CC=CC=C2

DOS

IR

Vibrations