Geometry & MOs

Info

ID:	402472
PubChem CID:	135056127
Reduced:	O3C16H16 (1)
Stoich.:	A3B16C16 (1)
Weight, g/mol:	290.151809
ΔH_f, kcal/mol:	-80.61
Dipole, Da:	1.67
IP(EA), eV:	-9.31(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-methoxy-2-methyl-5,10,15-trioxatetracyclo[9.5.2.03,7.08,17]octadeca-1,3(7),8(17)-triene

Drug info:

PubChemData

Smile

COC(=O)C1=C(C=C2COCC2C1)C3=CC=CC=C3

DOS

IR

Vibrations