Geometry & MOs

Info

ID:	284828
PubChem CID:	104073325
Reduced:	NOSC18H25 (1)
Stoich.:	ABCD18E25 (1)
Weight, g/mol:	220.067034
ΔH_f, kcal/mol:	-14.97
Dipole, Da:	0.8
IP(EA), eV:	-8.52(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(pyridin-2-ylsulfanylmethyl)furan-2-yl]methanamine

Drug info:

PubChemData

Smile

CCCNCC1=CC=C(O1)CSC2=CC=C(C=C2)C(C)C

DOS

IR

Vibrations