Geometry & MOs

Info

ID:	426149
PubChem CID:	135141433
Reduced:	NC3H4 (2)
Stoich.:	AB3C4 (2)
Weight, g/mol:	236.152478
ΔH_f, kcal/mol:	90.12
Dipole, Da:	2.37
IP(EA), eV:	-8.92(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethylspiro[1,4,5,7-tetrahydroindazole-6,4'-oxane]-4-ol

Drug info:

PubChemData

Smile

CC1N=CC(=C=N1)C

DOS

IR

Vibrations