Geometry & MOs

Info

ID:	240520
PubChem CID:	93581285
Reduced:	NO4C27H33 (1)
Stoich.:	AB4C27D33 (1)
Weight, g/mol:	393.194008
ΔH_f, kcal/mol:	-110.56
Dipole, Da:	3.52
IP(EA), eV:	-9.09(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)C1=CC=CC=C1OC[C@H](CN(CC2=CC=C(C=C2)C(C)(C)C)CC3=CC=CO3)O

DOS

IR

Vibrations