Geometry & MOs

Info

ID:	126216
PubChem CID:	50955602
Reduced:	OSN4C19H20 (1)
Stoich.:	ABC4D19E20 (1)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	43.39
Dipole, Da:	3.56
IP(EA), eV:	-9.26(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-3-(furan-2-yl)-2-methylprop-2-enyl]-3-(imidazol-1-ylmethyl)piperidine

Drug info:

PubChemData

Smile

CCC1=NC=C(C=N1)C(=O)N(CC2=CC=CC=N2)CC3=CC=C(S3)C

DOS

IR

Vibrations