Geometry & MOs

Info

ID:	136890
PubChem CID:	52119596
Reduced:	N4O5C20H20 (1)
Stoich.:	A4B5C20D20 (1)
Weight, g/mol:	342.169191
ΔH_f, kcal/mol:	-106.85
Dipole, Da:	6.02
IP(EA), eV:	-8.58(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[butyl(methyl)amino]-2-oxoethyl]-6-oxo-N-phenylpyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC(=O)CN2C(=O)C=CC(=N2)C(=O)NCC3=CC=CO3

DOS

IR

Vibrations