Geometry & MOs

Info

ID:	341434
PubChem CID:	127264127
Reduced:	O6C15H16 (1)
Stoich.:	A6B15C16 (1)
Weight, g/mol:	289.095023
ΔH_f, kcal/mol:	-207.52
Dipole, Da:	3.43
IP(EA), eV:	-9.24(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 13-methoxy-3,10-dioxa-4-azatricyclo[9.4.0.02,6]pentadeca-1(11),2(6),4,12,14-pentaene-5-carboxylate

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C(=O)C(CCCO2)C(=O)C(=O)OC

DOS

IR

Vibrations