Geometry & MOs

Info

ID:	240561
PubChem CID:	93581449
Reduced:	NO6C24H27 (1)
Stoich.:	AB6C24D27 (1)
Weight, g/mol:	425.183838
ΔH_f, kcal/mol:	-149.0
Dipole, Da:	3.02
IP(EA), eV:	-8.69(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2S)-3-[furan-2-ylmethyl-[(3-methoxyphenyl)methyl]amino]-2-hydroxypropoxy]-3-methoxybenzaldehyde

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN(CC2=CC=CO2)C[C@H](COC3=C(C=C(C=C3)C=O)OC)O

DOS

IR

Vibrations