Geometry & MOs

Info

ID:	341432
PubChem CID:	127264125
Reduced:	O4C15H16 (1)
Stoich.:	A4B15C16 (1)
Weight, g/mol:	257.105193
ΔH_f, kcal/mol:	-133.04
Dipole, Da:	3.34
IP(EA), eV:	-9.68(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-oxa-4-azatricyclo[9.4.0.02,6]pentadeca-1(15),2(6),4,11,13-pentaene-5-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C(=O)C1CCCCC2=CC=CC=C2C1=O

DOS

IR

Vibrations