Geometry & MOs

Info

ID:	74812
PubChem CID:	48422528
Reduced:	NO3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	341.14495
ΔH_f, kcal/mol:	-95.58
Dipole, Da:	5.01
IP(EA), eV:	-8.48(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)C(C)OCC2CC2

DOS

IR

Vibrations