Geometry & MOs

Info

ID:	230023
PubChem CID:	87569887
Reduced:	O3C11H12 (2)
Stoich.:	A3B11C12 (2)
Weight, g/mol:	303.231063
ΔH_f, kcal/mol:	-233.01
Dipole, Da:	1.37
IP(EA), eV:	-8.59(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)C3(C4=C(C=CC(=C4O)O)O)C5=C(C=CC(=C5O)O)O

DOS

IR

Vibrations