Geometry & MOs

Info

ID:	240496
PubChem CID:	93581033
Reduced:	NO7C26H31 (1)
Stoich.:	AB7C26D31 (1)
Weight, g/mol:	437.220223
ΔH_f, kcal/mol:	-199.58
Dipole, Da:	4.0
IP(EA), eV:	-8.67(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(2R)-3-[furan-2-ylmethyl-[(4-propoxyphenyl)methyl]amino]-2-hydroxypropoxy]phenyl]ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)OC[C@H](CN(CC2=CC=CO2)CC3=CC(=C(C(=C3)OC)OC)OC)O

DOS

IR

Vibrations