Geometry & MOs

Info

ID:	241018
PubChem CID:	93621198
Reduced:	SO2N3C17H21 (1)
Stoich.:	AB2C3D17E21 (1)
Weight, g/mol:	345.18009
ΔH_f, kcal/mol:	-40.21
Dipole, Da:	4.98
IP(EA), eV:	-8.13(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]pyridin-3-yl]-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@H](O1)C)C2=NC=C(C=C2)NC(=O)CC3=CC=CS3

DOS

IR

Vibrations