Geometry & MOs

Info

ID:	402095
PubChem CID:	135054328
Reduced:	N2O2H30C33 (1)
Stoich.:	A2B2C30D33 (1)
Weight, g/mol:	318.183109
ΔH_f, kcal/mol:	41.79
Dipole, Da:	2.8
IP(EA), eV:	-8.44(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-methoxy-2-methyl-5,10,17-trioxatetracyclo[9.7.2.03,7.08,19]icosa-1,3(7),8(19)-triene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@@H]2C[C@@H](C3=CC=CC(=C3N2)CC#CC4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5

DOS

IR

Vibrations