Geometry & MOs

Info

ID:	287596
PubChem CID:	104248021
Reduced:	ClOSN2C15H17 (1)
Stoich.:	ABCD2E15F17 (1)
Weight, g/mol:	274.204513
ΔH_f, kcal/mol:	-4.82
Dipole, Da:	5.21
IP(EA), eV:	-8.67(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(3-methylcyclohexyl)amino]ethyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one

Drug info:

PubChemData

Smile

C1CC2=C(C1)N(C(=O)C=C2)CCNCC3=CC=C(S3)Cl

DOS

IR

Vibrations