Geometry & MOs

Info

ID:	58144
PubChem CID:	24424345
Reduced:	ON2S2C18H22 (1)
Stoich.:	AB2C2D18E22 (1)
Weight, g/mol:	338.106454
ΔH_f, kcal/mol:	5.94
Dipole, Da:	7.06
IP(EA), eV:	-8.52(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-1-(2-methylphenyl)-3-[3-(trifluoromethyl)phenyl]thiourea

Drug info:

PubChemData

Smile

CCOCCCNC(=S)NC1=CC=CC=C1SC2=CC=CC=C2

DOS

IR

Vibrations