Geometry & MOs

Info

ID:	394772
PubChem CID:	135023739
Reduced:	OSN2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	259.157229
ΔH_f, kcal/mol:	23.3
Dipole, Da:	7.47
IP(EA), eV:	-8.44(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)(C)S(=O)N/C=C/1\C=NC2=CC=CC=C21

DOS

IR

Vibrations