Geometry & MOs

Info

ID:	341729
PubChem CID:	127264422
Reduced:	ClFO2N3C21H23 (1)
Stoich.:	ABC2D3E21F23 (1)
Weight, g/mol:	389.130633
ΔH_f, kcal/mol:	-118.14
Dipole, Da:	4.6
IP(EA), eV:	-9.09(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-4-fluorophenyl)-1-[(2-oxo-3,4-dihydro-1H-quinolin-3-yl)methyl]-1-propylurea

Drug info:

PubChemData

Smile

CC(C)CN(CC1CC2=CC=CC=C2NC1=O)C(=O)NC3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations