Geometry & MOs

Info

ID:	445698
PubChem CID:	135268984
Reduced:	O3N4C12H18 (1)
Stoich.:	A3B4C12D18 (1)
Weight, g/mol:	504.192131
ΔH_f, kcal/mol:	-119.46
Dipole, Da:	5.16
IP(EA), eV:	-9.02(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-fluoro-2-methoxy-5-(7-morpholin-4-ylquinazolin-4-yl)phenyl]-2-(1-methyl-6-oxopyridazin-3-yl)acetamide

Drug info:

PubChemData

Smile

CCN1C(=NC2=C1C(=O)N(C(=O)N2C)CCCO)C

DOS

IR

Vibrations