Geometry & MOs

Info

ID:	140261
PubChem CID:	52670991
Reduced:	N3O4C25H31 (1)
Stoich.:	A3B4C25D31 (1)
Weight, g/mol:	377.197751
ΔH_f, kcal/mol:	-127.06
Dipole, Da:	5.39
IP(EA), eV:	-9.45(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

diethyl-[4-[[2-(6-oxo-3-phenylpyridazin-1-yl)acetyl]amino]phenyl]azanium

Drug info:

PubChemData

Smile

C[C@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CN(C)C(=O)CCCOCCC3=CC=CC=C3

DOS

IR

Vibrations