Geometry & MOs

Info

ID:	122188
PubChem CID:	50797254
Reduced:	BrFN3O3H15C17 (1)
Stoich.:	ABC3D3E15F17 (1)
Weight, g/mol:	385.119319
ΔH_f, kcal/mol:	-114.0
Dipole, Da:	9.07
IP(EA), eV:	-8.81(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-chloro-2-oxo-4-phenylquinazolin-1-yl)-N-(3-methoxypropyl)acetamide

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C=C2)NC(=O)NC3=C(C=C(C=C3)Br)F)OC1=O

DOS

IR

Vibrations