Geometry & MOs

Info

ID:	244713
PubChem CID:	99381138
Reduced:	N3O4C22H29 (1)
Stoich.:	A3B4C22D29 (1)
Weight, g/mol:	352.153541
ΔH_f, kcal/mol:	-124.09
Dipole, Da:	3.38
IP(EA), eV:	-9.48(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[3-(6-oxo-1H-pyridazin-3-yl)phenyl]butanamide

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=N1)CCCNC(=O)C(C)(C)OC2=CC3=C(C=C2)C(=O)CCC3

DOS

IR

Vibrations