Geometry & MOs

Info

ID:	276312
PubChem CID:	103822111
Reduced:	OSN2C14H22 (1)
Stoich.:	ABC2D14E22 (1)
Weight, g/mol:	275.109233
ΔH_f, kcal/mol:	-49.95
Dipole, Da:	4.86
IP(EA), eV:	-9.12(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)-N-(1,3-benzothiazol-6-yl)cyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNC(=O)C2CCCC2CN

DOS

IR

Vibrations