Geometry & MOs

Info

ID:	431676
PubChem CID:	135171772
Reduced:	N3O4C28H29 (1)
Stoich.:	A3B4C28D29 (1)
Weight, g/mol:	382.178024
ΔH_f, kcal/mol:	-89.66
Dipole, Da:	6.16
IP(EA), eV:	-8.88(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-6-(9H-fluoren-9-ylmethoxy)-2-(2-hydroxypropan-2-yl)-6-oxohexanoic acid

Drug info:

PubChemData

Smile

CC1=NC=C(C=N1)C2=C(C=C3C(=C2)C(=CN3CC(=O)OC(C)(C)C)C(=O)C)OCC4=CC=CC=C4

DOS

IR

Vibrations