Geometry & MOs

Info

ID:	126924
PubChem CID:	50984534
Reduced:	ClON3H18C19 (1)
Stoich.:	ABC3D18E19 (1)
Weight, g/mol:	378.205576
ΔH_f, kcal/mol:	27.14
Dipole, Da:	3.33
IP(EA), eV:	-9.66(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-[2-[2-(dimethylamino)ethoxy]phenyl]-4-methyl-2,8,11-triazatricyclo[7.5.0.02,7]tetradeca-1(9),3,5,7-tetraen-12-one

Drug info:

PubChemData

Smile

CC(C)N(CC1=CC=CC=C1Cl)C(=O)C2=NC3=CC=CC=C3N=C2

DOS

IR

Vibrations