Geometry & MOs

Info

ID:	148855
PubChem CID:	53788524
Reduced:	NOC3H4 (4)
Stoich.:	ABC3D4 (4)
Weight, g/mol:	715.481189
ΔH_f, kcal/mol:	-2.69
Dipole, Da:	6.2
IP(EA), eV:	-9.26(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-[(2R,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxyoctadec-4-en-3-ol

Drug info:

PubChemData

Smile

CCC1=C(C(=C(C(=C1N)[N+](=O)[O-])NC2CC2)[N+](=O)[O-])C

DOS

IR

Vibrations