Geometry & MOs

Info

ID:	298820
PubChem CID:	117659268
Reduced:	F2O2N4H18C25 (1)
Stoich.:	A2B2C4D18E25 (1)
Weight, g/mol:	360.138639
ΔH_f, kcal/mol:	-19.58
Dipole, Da:	2.3
IP(EA), eV:	-8.65(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-fluorophenyl)-8-methoxy-N-methyl-2-pyridin-2-ylquinazolin-4-amine

Drug info:

PubChemData

Smile

CNC1=NC(=NC2=C1C=C(C=C2OCC3=CC=CO3)C4=CC(=CC(=C4)F)F)C5=CN=CC=C5

DOS

IR

Vibrations