Geometry & MOs

Info

ID:	137797
PubChem CID:	52264567
Reduced:	ClSO2N3H12C16 (1)
Stoich.:	ABC2D3E12F16 (1)
Weight, g/mol:	372.12224
ΔH_f, kcal/mol:	6.24
Dipole, Da:	2.59
IP(EA), eV:	-8.74(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxypyridin-3-yl)-4-oxo-3-phenylphthalazine-1-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=CC=N1)NC(=O)C2=CSC(=N2)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations