Geometry & MOs

Info

ID:	147909
PubChem CID:	53787569
Reduced:	C11H18 (1)
Stoich.:	A11B18 (1)
Weight, g/mol:	311.134385
ΔH_f, kcal/mol:	-1.37
Dipole, Da:	1.01
IP(EA), eV:	-9.57(1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-phenylphenyl)-3-(1,3-thiazinan-3-yl)propan-1-one

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H](C2(CC2)C(=C)C1)C

DOS

IR

Vibrations