Geometry & MOs

Info

ID:	257014
PubChem CID:	103143046
Reduced:	ON3H13C15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	181.146664
ΔH_f, kcal/mol:	39.45
Dipole, Da:	3.66
IP(EA), eV:	-9.36(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-3-[(5-methyloxolan-2-yl)methylidene]piperidine

Drug info:

PubChemData

Smile

CC1=NC=CC(=N1)C(C2=CC=CC3=C2C=NC=C3)O

DOS

IR

Vibrations