Geometry & MOs

Info

ID:	287595
PubChem CID:	104248002
Reduced:	ON3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	308.075012
ΔH_f, kcal/mol:	2.74
Dipole, Da:	5.15
IP(EA), eV:	-8.67(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(5-chlorothiophen-2-yl)methylamino]ethyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one

Drug info:

PubChemData

Smile

C1CC2=C(C1)N(C(=O)C=C2)CCNCC3=CN=CC=C3

DOS

IR

Vibrations