Geometry & MOs

Info

ID:	149927
PubChem CID:	53789609
Reduced:	SCl4C6H10 (1)
Stoich.:	AB4C6D10 (1)
Weight, g/mol:	404.950845
ΔH_f, kcal/mol:	-54.62
Dipole, Da:	1.99
IP(EA), eV:	-9.39(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-1-(2-nitrophenyl)sulfanyl-3-(2,4,6-trichlorophenyl)urea

Drug info:

PubChemData

Smile

C(C(CCl)Cl)SC(CCl)CCl

DOS

IR

Vibrations