Geometry & MOs

Info

ID:	129829
PubChem CID:	51073991
Reduced:	NO3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	275.098
ΔH_f, kcal/mol:	-119.63
Dipole, Da:	1.21
IP(EA), eV:	-8.54(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(furan-2-yl)-1-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-one

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2CCCN2C(=O)C3CCCO3

DOS

IR

Vibrations