Geometry & MOs

Info

ID:	84726
PubChem CID:	49869463
Reduced:	N3O3C24H25 (1)
Stoich.:	A3B3C24D25 (1)
Weight, g/mol:	446.211804
ΔH_f, kcal/mol:	-41.49
Dipole, Da:	2.68
IP(EA), eV:	-8.02(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-fluoropyridin-2-yl)methoxy]-1-(10-methyl-1,2,3,5,5a,10a,11,11a-octahydroindolizino[7,6-b]indol-8-yl)pyridin-2-one

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)N3C=CC=C3C4(N2)CCN(CC4)C5=CC6=C(C=C5)OCCO6

DOS

IR

Vibrations