Geometry & MOs

Info

ID:	206376
PubChem CID:	80241111
Reduced:	NO2S2C15H15 (1)
Stoich.:	AB2C2D15E15 (1)
Weight, g/mol:	275.199762
ΔH_f, kcal/mol:	4.64
Dipole, Da:	3.67
IP(EA), eV:	-8.85(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC=C1CNC(=O)C2=CSC(=C2)C#CCCO

DOS

IR

Vibrations