Geometry & MOs

Info

ID:	371380
PubChem CID:	127346086
Reduced:	N2O4H22C23 (1)
Stoich.:	A2B4C22D23 (1)
Weight, g/mol:	390.205576
ΔH_f, kcal/mol:	-90.13
Dipole, Da:	4.93
IP(EA), eV:	-8.2(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(11-azatricyclo[6.2.1.02,7]undeca-2,4,6-trien-11-yl)-3-(3-methoxy-1,4,6-trimethylpyrazolo[3,4-b]pyridin-5-yl)propan-1-one

Drug info:

PubChemData

Smile

C1CC2C3=CC=CC=C3C1N2C(=O)C4CC(=O)N(C4)C5=CC6=C(C=C5)OCCO6

DOS

IR

Vibrations