Geometry & MOs

Info

ID:	233740
PubChem CID:	92093221
Reduced:	SN3O3C20H21 (1)
Stoich.:	AB3C3D20E21 (1)
Weight, g/mol:	230.105528
ΔH_f, kcal/mol:	-30.52
Dipole, Da:	6.55
IP(EA), eV:	-8.85(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[6-(furan-2-yl)pyridin-3-yl]methyl]propanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OCCCS(=O)(=O)NCC2=C(N=CC=C2)C3=CC=NC=C3

DOS

IR

Vibrations