Geometry & MOs

Info

ID:	240372
PubChem CID:	93578018
Reduced:	NO4C19H25 (1)
Stoich.:	AB4C19D25 (1)
Weight, g/mol:	361.171165
ΔH_f, kcal/mol:	-119.07
Dipole, Da:	2.6
IP(EA), eV:	-8.93(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[(3-methylthiophen-2-yl)methyl-[[(2S)-oxolan-2-yl]methyl]amino]-3-phenoxypropan-2-ol

Drug info:

PubChemData

Smile

C1C[C@H](OC1)CN(CC2=CC=CO2)C[C@@H](COC3=CC=CC=C3)O

DOS

IR

Vibrations