Geometry & MOs

Info

ID:	48189
PubChem CID:	10537782
Reduced:	O3C14H20 (1)
Stoich.:	A3B14C20 (1)
Weight, g/mol:	236.152478
ΔH_f, kcal/mol:	-138.15
Dipole, Da:	3.9
IP(EA), eV:	-10.11(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-4-pyrrolidin-1-yl-4,5,6,7-tetrahydro-1,2-benzoxazole

Drug info:

PubChemData

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C[C@@]1([C@@H]2[C@H](CC(=O)C13CC3)CC(C2=O)(C)C)O

DOS

IR

Vibrations