Geometry & MOs

Info

ID:	288903
PubChem CID:	104327993
Reduced:	ClFN2H12C16 (1)
Stoich.:	ABC2D12E16 (1)
Weight, g/mol:	290.042232
ΔH_f, kcal/mol:	13.17
Dipole, Da:	3.57
IP(EA), eV:	-9.27(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-7-fluoro-2-(4-fluoro-2-methylphenyl)quinazoline

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C(=NC(=N2)C3=C(C=C(C=C3)F)C)Cl

DOS

IR

Vibrations