Geometry & MOs

Info

ID:	178731
PubChem CID:	76372958
Reduced:	N2O5C17H22 (1)
Stoich.:	A2B5C17D22 (1)
Weight, g/mol:	279.125929
ΔH_f, kcal/mol:	-195.63
Dipole, Da:	3.75
IP(EA), eV:	-9.56(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methylidenepyridin-2-ylidene)-3-(3-oxocyclohexyl)cyclohexa-2,5-dien-1-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC2COC2=O

DOS

IR

Vibrations