Geometry & MOs

Info

ID:	288902
PubChem CID:	104327984
Reduced:	FON2C16H23 (1)
Stoich.:	ABC2D16E23 (1)
Weight, g/mol:	286.067304
ΔH_f, kcal/mol:	-101.71
Dipole, Da:	4.65
IP(EA), eV:	-9.2(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-(4-fluoro-2-methylphenyl)-8-methylquinazoline

Drug info:

PubChemData

Smile

CCC1CCCNC1CNC(=O)C2=C(C=C(C=C2)F)C

DOS

IR

Vibrations