Geometry & MOs

Info

ID:	247714
PubChem CID:	103072865
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	262.113984
ΔH_f, kcal/mol:	17.04
Dipole, Da:	2.89
IP(EA), eV:	-8.49(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-[(propan-2-ylamino)methyl]prop-2-enyl]thieno[3,2-c]pyridin-4-one

Drug info:

PubChemData

Smile

CN1CC2=CC=CC=C2N(C1=O)CC(=C)CNC3CC3

DOS

IR

Vibrations