Geometry & MOs

Info

ID:	413103
PubChem CID:	135086047
Reduced:	NO4H15C17 (1)
Stoich.:	AB4C15D17 (1)
Weight, g/mol:	235.103085
ΔH_f, kcal/mol:	-65.99
Dipole, Da:	4.79
IP(EA), eV:	-9.3(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-2-methyl-N-[(1S)-1-phenylprop-2-ynyl]propane-2-sulfinamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=CCOC(=O)NOC(=O)C2=CC=CC=C2

DOS

IR

Vibrations