Geometry & MOs

Info

ID:	253601
PubChem CID:	103119505
Reduced:	N2O3C10H12 (1)
Stoich.:	A2B3C10D12 (1)
Weight, g/mol:	258.100442
ΔH_f, kcal/mol:	-73.96
Dipole, Da:	5.18
IP(EA), eV:	-9.96(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-methylindazole-3-carbonyl)oxan-4-one

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)C2COCCC2=O

DOS

IR

Vibrations