Geometry & MOs

Info

ID:	357288
PubChem CID:	127293921
Reduced:	SN3O3C18H25 (1)
Stoich.:	AB3C3D18E25 (1)
Weight, g/mol:	301.142641
ΔH_f, kcal/mol:	-114.07
Dipole, Da:	2.44
IP(EA), eV:	-8.76(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methoxyquinolin-6-yl)-1-methyl-1-(oxolan-3-yl)urea

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CCSCC2)NC(=O)N(C)C3CCOC3

DOS

IR

Vibrations