Geometry & MOs

Info

ID:	150063
PubChem CID:	53789748
Reduced:	NO3C20H27 (1)
Stoich.:	AB3C20D27 (1)
Weight, g/mol:	590.299202
ΔH_f, kcal/mol:	-85.7
Dipole, Da:	3.92
IP(EA), eV:	-8.89(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxyethoxy)ethyl N-[(2S,3S,5R)-5-benzyl-3-hydroxy-6-[[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-6-oxo-1-phenylhexan-2-yl]carbamate

Drug info:

PubChemData

Smile

CN(C)CC#CCC1=CC=C(C=C1)[C@](C2CCCCC2)(C(=O)O)O

DOS

IR

Vibrations