Geometry & MOs

Info

ID:	143230
PubChem CID:	53169193
Reduced:	FOSN2H13C17 (1)
Stoich.:	ABCD2E13F17 (1)
Weight, g/mol:	387.114983
ΔH_f, kcal/mol:	2.03
Dipole, Da:	3.84
IP(EA), eV:	-9.28(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-1'-[2-(3-fluorophenyl)acetyl]spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC(=O)C2=CC(=NS2)C3=CC(=CC=C3)F

DOS

IR

Vibrations