Geometry & MOs

Info

ID:	148179
PubChem CID:	53787841
Reduced:	OS2C10H10 (1)
Stoich.:	AB2C10D10 (1)
Weight, g/mol:	300.129634
ΔH_f, kcal/mol:	5.13
Dipole, Da:	2.54
IP(EA), eV:	-8.41(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(diethylamino)-2-[5-(2-thiophen-2-ylethynyl)pyridin-2-yl]ethanol

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C2=CSC(=C2)OC

DOS

IR

Vibrations