Geometry & MOs

Info

ID:	78720
PubChem CID:	49703923
Reduced:	SN4O5C20H26 (1)
Stoich.:	AB4C5D20E26 (1)
Weight, g/mol:	448.211055
ΔH_f, kcal/mol:	-147.46
Dipole, Da:	8.66
IP(EA), eV:	-8.93(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-ethoxyphenyl)-6-oxopyridazin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)C(C)C(=O)N3CCN(CC3)S(=O)(=O)C

DOS

IR

Vibrations