Geometry & MOs

Info

ID:	58101
PubChem CID:	24424051
Reduced:	ClSN2F3H8C13 (1)
Stoich.:	ABC2D3E8F13 (1)
Weight, g/mol:	310.075154
ΔH_f, kcal/mol:	-78.74
Dipole, Da:	3.86
IP(EA), eV:	-9.03(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dimethylphenyl)-3-(2,3,4-trifluorophenyl)thiourea

Drug info:

PubChemData

Smile

C1=CC(=CC=C1NC(=S)NC2=C(C(=C(C=C2)F)F)F)Cl

DOS

IR

Vibrations