Geometry & MOs

Info

ID:	427704
PubChem CID:	135161470
Reduced:	N2O4C25H34 (1)
Stoich.:	A2B4C25D34 (1)
Weight, g/mol:	282.153227
ΔH_f, kcal/mol:	-141.05
Dipole, Da:	6.24
IP(EA), eV:	-8.39(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-4-methyl-3-phenyl-2-propyl-4H-quinazoline

Drug info:

PubChemData

Smile

CC(CCOC(C)(C)C(=O)C1=CC=C(C=C1)N(C)C)OC(=O)C2=CC=C(C=C2)N(C)C

DOS

IR

Vibrations