Geometry & MOs

Info

ID:	336300
PubChem CID:	127255307
Reduced:	N4O5H24C28 (1)
Stoich.:	A4B5C24D28 (1)
Weight, g/mol:	295.132077
ΔH_f, kcal/mol:	-88.62
Dipole, Da:	5.92
IP(EA), eV:	-8.25(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-(2-methylpropyl)-8-oxa-14,15,17-triazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,12,16-hexaen-9-one

Drug info:

PubChemData

Smile

CN1C=CC2=C1C=CC(=C2)NC(=O)CN3C4C5=C(C(=C(C=C5)OC)OC)C(=O)N4C6=CC=CC=C6C3=O

DOS

IR

Vibrations