Geometry & MOs

Info

ID:	233768
PubChem CID:	92093396
Reduced:	SO2N3H17C20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	244.121178
ΔH_f, kcal/mol:	20.39
Dipole, Da:	4.41
IP(EA), eV:	-9.03(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=NC2=C(S1)C=C(C=C2)C(=O)NCC3=CN=C(C=C3)C4=CC=CO4

DOS

IR

Vibrations