Geometry & MOs

Info

ID:	24921
PubChem CID:	614605
Reduced:	NO5C18H19 (1)
Stoich.:	AB5C18D19 (1)
Weight, g/mol:	329.126323
ΔH_f, kcal/mol:	-166.89
Dipole, Da:	1.56
IP(EA), eV:	-8.68(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(17-hydroxy-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,15-tetraen-18-yl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC1C(C=C2CCN3C2C1C4=CC5=C(C=C4C3)OCO5)O

DOS

IR

Vibrations