Geometry & MOs

Info

ID:	69771
PubChem CID:	47205359
Reduced:	ON3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	268.157563
ΔH_f, kcal/mol:	-16.56
Dipole, Da:	6.49
IP(EA), eV:	-8.41(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylpiperidin-1-yl)-(4-phenyl-1H-pyrrol-3-yl)methanone

Drug info:

PubChemData

Smile

CCCCCNC(=O)C1=CC=C(C=C1)N2CCC(=N2)C

DOS

IR

Vibrations