Geometry & MOs

Info

ID:	58051
PubChem CID:	24423726
Reduced:	SN3O3C20H25 (1)
Stoich.:	AB3C3D20E25 (1)
Weight, g/mol:	327.158075
ΔH_f, kcal/mol:	-74.96
Dipole, Da:	6.06
IP(EA), eV:	-8.43(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-difluorophenyl)-3-(2,2,6,6-tetramethylpiperidin-4-yl)thiourea

Drug info:

PubChemData

Smile

CCOCCCNC(=S)NC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)OC

DOS

IR

Vibrations