Geometry & MOs

Info

ID:	296559
PubChem CID:	117584092
Reduced:	O2S2N3C9H11 (1)
Stoich.:	A2B2C3D9E11 (1)
Weight, g/mol:	311.03433
ΔH_f, kcal/mol:	-20.14
Dipole, Da:	5.33
IP(EA), eV:	-8.41(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-adamantyl)-5-bromothiophen-2-amine

Drug info:

PubChemData

Smile

C1=CNC=C1NS(=O)(=O)C2=CC=C(S2)CN

DOS

IR

Vibrations