Geometry & MOs

Info

ID:	140989
PubChem CID:	52795518
Reduced:	FO2N3C25H26 (1)
Stoich.:	AB2C3D25E26 (1)
Weight, g/mol:	330.170533
ΔH_f, kcal/mol:	-61.95
Dipole, Da:	4.74
IP(EA), eV:	-9.08(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2,3-dihydro-1,4-benzodioxin-5-ylmethyl-(furan-2-ylmethyl)-[[(2R)-oxolan-2-yl]methyl]azanium

Drug info:

PubChemData

Smile

CN(C)C1=C(C=C(C=C1)CNC(=O)C[C@@H](C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)F

DOS

IR

Vibrations