Geometry & MOs

Info

ID:	179001
PubChem CID:	76417412
Reduced:	O3C13H16 (1)
Stoich.:	A3B13C16 (1)
Weight, g/mol:	655.384919
ΔH_f, kcal/mol:	-119.9
Dipole, Da:	5.32
IP(EA), eV:	-10.01(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[3-[hexadecoxy(phenylmethoxy)phosphoryl]-2-oxopropyl]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

Drug info:

PubChemData

Smile

CC12CC3(CC1CC(O2)O)C=CC(=O)C=C3

DOS

IR

Vibrations