Geometry & MOs

Info

ID:	130758
PubChem CID:	51100293
Reduced:	N2O5C18H22 (1)
Stoich.:	A2B5C18D22 (1)
Weight, g/mol:	341.210327
ΔH_f, kcal/mol:	-125.91
Dipole, Da:	3.49
IP(EA), eV:	-8.64(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclooctyl-N-methyl-2-(4-methyl-1-oxophthalazin-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1(CN(CCO1)C(=O)C2=NOC(=C2)C3=C(C=CC(=C3)OC)OC)C

DOS

IR

Vibrations