Geometry & MOs

Info

ID:	443539
PubChem CID:	135259281
Reduced:	ClO2N5H18C20 (1)
Stoich.:	AB2C5D18E20 (1)
Weight, g/mol:	435.190654
ΔH_f, kcal/mol:	-22.62
Dipole, Da:	4.07
IP(EA), eV:	-8.89(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C2C(=O)NC3(N2C(=O)C(=C1)NC4=NC=NC5=C4C=CC(=C5)Cl)CCCC3

DOS

IR

Vibrations