Geometry & MOs

Info

ID:	145176
PubChem CID:	53474316
Reduced:	Cl2O2N3C16H19 (1)
Stoich.:	A2B2C3D16E19 (1)
Weight, g/mol:	364.178693
ΔH_f, kcal/mol:	-37.31
Dipole, Da:	5.5
IP(EA), eV:	-8.97(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-6-methoxy-7-phenylmethoxy-1H-quinazolin-4-one

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)Cl)OCCCN3CCCC3

DOS

IR

Vibrations