Geometry & MOs

Info

ID:	219975
PubChem CID:	85165104
Reduced:	PF3N3O9C26H39 (1)
Stoich.:	AB3C3D9E26F39 (1)
Weight, g/mol:	625.267567
ΔH_f, kcal/mol:	-637.2
Dipole, Da:	3.91
IP(EA), eV:	-9.41(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-oxo-2-[[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]amino]acetate

Drug info:

PubChemData

Smile

CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)C(CC1=CC=C(C=C1)OP(=O)(O)O)NC(=O)C(F)(F)F

DOS

IR

Vibrations