Geometry & MOs

Info

ID:	389701
PubChem CID:	134994526
Reduced:	BrOSC10H21 (1)
Stoich.:	ABCD10E21 (1)
Weight, g/mol:	235.139471
ΔH_f, kcal/mol:	-74.6
Dipole, Da:	6.66
IP(EA), eV:	-8.27(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-1-(2-methylphenyl)iminothiane

Drug info:

PubChemData

Smile

CC(C)(C)S(=O)CCCCCCBr

DOS

IR

Vibrations