Geometry & MOs

Info

ID:	255863
PubChem CID:	103135250
Reduced:	N2O4C11H16 (1)
Stoich.:	A2B4C11D16 (1)
Weight, g/mol:	288.111007
ΔH_f, kcal/mol:	-159.21
Dipole, Da:	2.41
IP(EA), eV:	-9.69(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-methyloxolan-2-yl)methyl]-4-oxophthalazine-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1CCC(O1)CN2C(=O)CCC(=N2)C(=O)O

DOS

IR

Vibrations