Geometry & MOs

Info

ID:	374778
PubChem CID:	131342994
Reduced:	SN2O2C10H14 (1)
Stoich.:	AB2C2D10E14 (1)
Weight, g/mol:	261.009363
ΔH_f, kcal/mol:	-59.32
Dipole, Da:	3.55
IP(EA), eV:	-8.61(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(difluoromethoxy)-7-methylsulfanyl-1-benzothiophen-3-amine

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)C(=O)O)C2CCSCC2

DOS

IR

Vibrations