Geometry & MOs

Info

ID:	417382
PubChem CID:	135092970
Reduced:	ON6C15H18 (1)
Stoich.:	AB6C15D18 (1)
Weight, g/mol:	535.217932
ΔH_f, kcal/mol:	20.57
Dipole, Da:	1.8
IP(EA), eV:	-8.98(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methoxy-9,18-dioxa-1,12,13,14,23,26,29-heptazapentacyclo[27.2.2.111,14.03,8.019,24]tetratriaconta-3(8),4,6,11(34),12,19(24),20,22-octaene-2,25,28-trione

Drug info:

PubChemData

Smile

C1CC2(CCC3=CN=C(N=C32)N)CN(C1)C(=O)C4=NC=CN4

DOS

IR

Vibrations