Geometry & MOs

Info

ID:	361497
PubChem CID:	127303687
Reduced:	ON2C14H22 (1)
Stoich.:	AB2C14D22 (1)
Weight, g/mol:	365.267842
ΔH_f, kcal/mol:	-49.96
Dipole, Da:	2.77
IP(EA), eV:	-8.58(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-[3-(oxan-2-yl)propanoyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1CCCC(N1C(=O)C2=CC=C(N2C)C)C

DOS

IR

Vibrations