Geometry & MOs

Info

ID:	448553
PubChem CID:	135291813
Reduced:	NSO3C8H15 (1)
Stoich.:	ABC3D8E15 (1)
Weight, g/mol:	220.036957
ΔH_f, kcal/mol:	-133.31
Dipole, Da:	6.22
IP(EA), eV:	-8.96(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(difluoromethoxy)-2-methoxy-4-methylsulfanylbenzene

Drug info:

PubChemData

Smile

CSO[C@H]1CCCN(C1)C(=O)CO

DOS

IR

Vibrations