Geometry & MOs

Info

ID:	51260
PubChem CID:	12013903
Reduced:	Cl2O2N4H20C23 (1)
Stoich.:	A2B2C4D20E23 (1)
Weight, g/mol:	506.216535
ΔH_f, kcal/mol:	-26.35
Dipole, Da:	5.34
IP(EA), eV:	-9.52(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)-2,2-dimethylcyclobutyl]methyl]-6,7-dimethoxy-1H-quinazolin-4-one

Drug info:

PubChemData

Smile

CC1(C(CC1C2=NC(=O)C3=C(N2)C=C(C=C3)Cl)CC4=NC(=O)C5=C(N4)C=C(C=C5)Cl)C

DOS

IR

Vibrations