Geometry & MOs

Info

ID:	420975
PubChem CID:	135115147
Reduced:	O2N5C14H23 (1)
Stoich.:	A2B5C14D23 (1)
Weight, g/mol:	441.237604
ΔH_f, kcal/mol:	-78.92
Dipole, Da:	3.37
IP(EA), eV:	-9.88(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-2-methyl-10-oxa-2,14,15,16,22-pentazatetracyclo[20.2.2.114,17.04,9]heptacosa-4(9),5,7,15,17(27)-pentaene-3,21-dione

Drug info:

PubChemData

Smile

CC(C1=NN=CN1C)NC(=O)CCC(=O)NC2CCCC2

DOS

IR

Vibrations