Geometry & MOs

Info

ID:	240940
PubChem CID:	93618326
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-109.28
Dipole, Da:	4.23
IP(EA), eV:	-9.87(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(1R,2R)-2-methylcyclohexyl]oxyethyl]-6-oxo-1H-pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@H]1CCCC[C@@H]1OCCNC(=O)C2=NNC(=O)C=C2

DOS

IR

Vibrations