Geometry & MOs

Info

ID:	309419
PubChem CID:	126546131
Reduced:	ON2C9H10 (2)
Stoich.:	AB2C9D10 (2)
Weight, g/mol:	176.120115
ΔH_f, kcal/mol:	41.38
Dipole, Da:	4.52
IP(EA), eV:	-9.24(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-ethylphenyl)oxolane

Drug info:

PubChemData

Smile

C1CN(CC2=CC=CC=C21)CC(CNC(=O)C3=CN=C=CN=C3)O

DOS

IR

Vibrations