Geometry & MOs

Info

ID:	211067
PubChem CID:	80892121
Reduced:	S2N5C10H11 (1)
Stoich.:	A2B5C10D11 (1)
Weight, g/mol:	270.11907
ΔH_f, kcal/mol:	80.22
Dipole, Da:	6.5
IP(EA), eV:	-8.68(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-ethylpyridin-2-amine

Drug info:

PubChemData

Smile

CC1=CN=C(N=C1)SC2=NC(=NC(=C2)N)SC

DOS

IR

Vibrations