Geometry & MOs

Info

ID:	388521
PubChem CID:	134989378
Reduced:	NSO2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	213.073597
ΔH_f, kcal/mol:	-40.56
Dipole, Da:	3.43
IP(EA), eV:	-9.21(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-fluorophenyl)methylamino]-3-methylthiourea

Drug info:

PubChemData

Smile

CCN(CC)OC(=O)SC1=CC=CC=C1

DOS

IR

Vibrations