Geometry & MOs

Info

ID:	58117
PubChem CID:	24424216
Reduced:	OSN2C18H22 (1)
Stoich.:	ABC2D18E22 (1)
Weight, g/mol:	419.17012
ΔH_f, kcal/mol:	9.83
Dipole, Da:	6.97
IP(EA), eV:	-8.2(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-[5-(diethylsulfamoyl)-2-methylphenyl]-1-ethylthiourea

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1)C(=S)NCC2=CC=C(C=C2)OC

DOS

IR

Vibrations