Geometry & MOs

Info

ID:	443472
PubChem CID:	135259136
Reduced:	FON3C10H11 (2)
Stoich.:	ABC3D10E11 (2)
Weight, g/mol:	409.130553
ΔH_f, kcal/mol:	-106.45
Dipole, Da:	2.96
IP(EA), eV:	-8.76(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(7-chloroquinazolin-4-yl)amino]-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione

Drug info:

PubChemData

Smile

C/C(=C/1\C(=O)NC2(N1C)CCC(CC2)(F)F)/C=C(\C=O)/NC3=NC=NC4=C3C=CN4

DOS

IR

Vibrations