Geometry & MOs

Info

ID:	79415
PubChem CID:	49748515
Reduced:	FS2N3O5C25H26 (1)
Stoich.:	AB2C3D5E25F26 (1)
Weight, g/mol:	301.179027
ΔH_f, kcal/mol:	-196.71
Dipole, Da:	10.14
IP(EA), eV:	-8.33(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-3-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-6-yl]urea

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCCN3S(=O)(=O)C4=CC=C(C=C4)F)C=C2

DOS

IR

Vibrations