Geometry & MOs

Info

ID:	240409
PubChem CID:	93578251
Reduced:	NSO3C21H25 (1)
Stoich.:	ABC3D21E25 (1)
Weight, g/mol:	385.144471
ΔH_f, kcal/mol:	-61.2
Dipole, Da:	2.71
IP(EA), eV:	-8.84(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-[(2-chlorophenyl)methyl-(furan-2-ylmethyl)amino]-3-(3-methylphenoxy)propan-2-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OC[C@H](CN(CC2=CC=CO2)CC3=C(C=CS3)C)O

DOS

IR

Vibrations