Geometry & MOs

Info

ID:	78638
PubChem CID:	49703288
Reduced:	O3N4C20H20 (1)
Stoich.:	A3B4C20D20 (1)
Weight, g/mol:	351.133139
ΔH_f, kcal/mol:	-28.58
Dipole, Da:	5.84
IP(EA), eV:	-9.08(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]-N-pyrimidin-2-ylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CC=NC=C1)N2C(=O)C=CC(=N2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations