Geometry & MOs

Info

ID:	256449
PubChem CID:	103139287
Reduced:	SN3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	211.157229
ΔH_f, kcal/mol:	40.64
Dipole, Da:	4.36
IP(EA), eV:	-8.36(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-methyloxolan-2-yl)methyl]piperidine-2-carbaldehyde

Drug info:

PubChemData

Smile

CCC1CN(CCS1)C2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations