Geometry & MOs

Info

ID:	240358
PubChem CID:	93577975
Reduced:	N2O3C23H32 (1)
Stoich.:	A2B3C23D32 (1)
Weight, g/mol:	384.241293
ΔH_f, kcal/mol:	-88.01
Dipole, Da:	5.91
IP(EA), eV:	-8.12(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[[4-(dimethylamino)phenyl]methyl-[[(2R)-oxolan-2-yl]methyl]amino]-3-phenoxypropan-2-ol

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)CN(C[C@@H]2CCCO2)C[C@@H](COC3=CC=CC=C3)O

DOS

IR

Vibrations