Geometry & MOs

Info

ID:	380615
PubChem CID:	134971107
Reduced:	NC14H23 (1)
Stoich.:	AB14C23 (1)
Weight, g/mol:	251.136887
ΔH_f, kcal/mol:	2.43
Dipole, Da:	1.42
IP(EA), eV:	-7.58(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,6S)-4-(3-aminopropoxy)-2-(hydroxymethyl)-6-methoxyoxane-3,5-diol

Drug info:

PubChemData

Smile

CCCN(CC)C1=C(C=C(C=C1C)C)C

DOS

IR

Vibrations