Geometry & MOs

Info

ID:	159775
PubChem CID:	57288737
Reduced:	OC5H9 (4)
Stoich.:	AB5C9 (4)
Weight, g/mol:	449.096476
ΔH_f, kcal/mol:	-196.78
Dipole, Da:	2.63
IP(EA), eV:	-9.48(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chloro-2-methylphenyl)-3-[4-(quinolin-2-ylmethoxy)phenyl]-1-sulfanylurea

Drug info:

PubChemData

Smile

CCC(C)OC(=O)C1(CO1)CCCCOC2CCCCCCCC2

DOS

IR

Vibrations