Geometry & MOs

Info

ID:	214227
PubChem CID:	84974706
Reduced:	BrON2C19H21 (1)
Stoich.:	ABC2D19E21 (1)
Weight, g/mol:	298.204513
ΔH_f, kcal/mol:	12.34
Dipole, Da:	6.16
IP(EA), eV:	-8.74(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopent-2-en-1-yl-N-[4-(4-methylpiperidin-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)CC=CC2=CC=CC=C2

DOS

IR

Vibrations