Geometry & MOs

Info

ID:	69958
PubChem CID:	47205971
Reduced:	OSCl2N2C14H14 (1)
Stoich.:	ABC2D2E14F14 (1)
Weight, g/mol:	288.129634
ΔH_f, kcal/mol:	-25.71
Dipole, Da:	4.3
IP(EA), eV:	-9.11(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylphenyl)-3-[(5-ethylthiophen-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNC(=O)NC2=C(C=CC(=C2)Cl)Cl

DOS

IR

Vibrations