Geometry & MOs

Info

ID:	79371
PubChem CID:	49748294
Reduced:	F3N3O3H18C22 (1)
Stoich.:	A3B3C3D18E22 (1)
Weight, g/mol:	429.064697
ΔH_f, kcal/mol:	-204.36
Dipole, Da:	7.6
IP(EA), eV:	-8.74(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dichlorophenyl)-3-[1-(furan-2-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]urea

Drug info:

PubChemData

Smile

C1CC2=C(C=C(C=C2)NC(=O)NC3=CC=CC(=C3)C(F)(F)F)N(C1)C(=O)C4=CC=CO4

DOS

IR

Vibrations