Geometry & MOs

Info

ID:	150512
PubChem CID:	53790205
Reduced:	SN2O2C10H10 (1)
Stoich.:	AB2C2D10E10 (1)
Weight, g/mol:	189.078979
ΔH_f, kcal/mol:	-26.98
Dipole, Da:	3.16
IP(EA), eV:	-9.37(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzyliminooxolan-2-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(S2)C(=O)OCCN

DOS

IR

Vibrations