Geometry & MOs

Info

ID:	274449
PubChem CID:	103809425
Reduced:	OSN3H11C14 (1)
Stoich.:	ABC3D11E14 (1)
Weight, g/mol:	275.109233
ΔH_f, kcal/mol:	33.72
Dipole, Da:	5.26
IP(EA), eV:	-8.85(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-(1,3-benzothiazol-6-yl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)N)C(=O)NC2=CC3=C(C=C2)N=CS3

DOS

IR

Vibrations