Geometry & MOs

Info

ID:	30919
PubChem CID:	853793
Reduced:	N2O4H14C15 (1)
Stoich.:	A2B4C14D15 (1)
Weight, g/mol:	206.051384
ΔH_f, kcal/mol:	-115.63
Dipole, Da:	9.67
IP(EA), eV:	-8.85(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-methyl-3-phenyl-2-sulfanylideneimidazolidin-4-one

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)C(=O)O

DOS

IR

Vibrations