Geometry & MOs

Info

ID:	446044
PubChem CID:	135271957
Reduced:	ON2C10H14 (1)
Stoich.:	AB2C10D14 (1)
Weight, g/mol:	275.209658
ΔH_f, kcal/mol:	5.44
Dipole, Da:	1.01
IP(EA), eV:	-8.68(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-4-[(2S,4S,5S)-4-methoxy-5-(methylamino)oxan-2-yl]oxy-5-methylhexan-3-ol

Drug info:

PubChemData

Smile

CC(=C)OCC1=CC=C(C=C1)NN

DOS

IR

Vibrations