Geometry & MOs

Info

ID:	19688
PubChem CID:	570386
Reduced:	NO5H23C24 (1)
Stoich.:	AB5C23D24 (1)
Weight, g/mol:	405.157623
ΔH_f, kcal/mol:	-122.22
Dipole, Da:	2.49
IP(EA), eV:	-8.72(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(15-methoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraen-18-yl) benzoate

Drug info:

PubChemData

Smile

COC1CC2C3(C=C1)C(CN2CC4=CC5=C(C=C34)OCO5)OC(=O)C6=CC=CC=C6

DOS

IR

Vibrations