Geometry & MOs

Info

ID:	221084
PubChem CID:	85256753
Reduced:	C5H8 (4)
Stoich.:	A5B8 (4)
Weight, g/mol:	273.074956
ΔH_f, kcal/mol:	-2.11
Dipole, Da:	1.04
IP(EA), eV:	-9.22(1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-hydroxy-4-oxa-2,5,11-triazatetracyclo[11.4.0.02,6.07,11]heptadeca-1(17),5,13,15-tetraene-3,12-dione

Drug info:

PubChemData

Smile

CC(=C)CCC=C(C)C1CCC(C(C1)C(=C)C)(C)C=C

DOS

IR

Vibrations