Geometry & MOs

Info

ID:	135424
PubChem CID:	51869885
Reduced:	O2S3N4C18H20 (1)
Stoich.:	A2B3C4D18E20 (1)
Weight, g/mol:	273.100108
ΔH_f, kcal/mol:	27.24
Dipole, Da:	2.5
IP(EA), eV:	-8.52(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methylfuran-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C2=NC(=CS2)CSC3=NN=C(S3)NC[C@H]4CCCO4

DOS

IR

Vibrations