Geometry & MOs

Info

ID:	290023
PubChem CID:	104397939
Reduced:	OSN3C14H19 (1)
Stoich.:	ABC3D14E19 (1)
Weight, g/mol:	272.163711
ΔH_f, kcal/mol:	-11.35
Dipole, Da:	4.06
IP(EA), eV:	-8.75(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)amino]-N-propan-2-ylpropanamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)C(C)NC1=C(C(=CC=C1)SC)C#N

DOS

IR

Vibrations