Geometry & MOs

Info

ID:	74421
PubChem CID:	48421844
Reduced:	NSO2C12H17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	285.172879
ΔH_f, kcal/mol:	-51.09
Dipole, Da:	3.02
IP(EA), eV:	-9.3(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CC=CS1)OCC2CC2

DOS

IR

Vibrations