Geometry & MOs

Info

ID:	69481
PubChem CID:	47193017
Reduced:	N2O2F3C13H15 (1)
Stoich.:	A2B2C3D13E15 (1)
Weight, g/mol:	294.059362
ΔH_f, kcal/mol:	-228.08
Dipole, Da:	1.73
IP(EA), eV:	-9.38(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chloro-2-methylphenyl)-1-methyl-1-(thiophen-2-ylmethyl)urea

Drug info:

PubChemData

Smile

C1COCC1CNC(=O)NC2=CC=CC=C2C(F)(F)F

DOS

IR

Vibrations