Geometry & MOs

Info

ID:	297209
PubChem CID:	117612979
Reduced:	O3N5C11H19 (1)
Stoich.:	A3B5C11D19 (1)
Weight, g/mol:	409.131408
ΔH_f, kcal/mol:	-91.52
Dipole, Da:	6.68
IP(EA), eV:	-9.34(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

24-benzyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaene

Drug info:

PubChemData

Smile

CC(C)OCCOCN1C=NC2C1N=C(NC2=O)N

DOS

IR

Vibrations