Geometry & MOs

Info

ID:	449927
PubChem CID:	135302598
Reduced:	NO6C9H17 (1)
Stoich.:	AB6C9D17 (1)
Weight, g/mol:	393.175599
ΔH_f, kcal/mol:	-281.11
Dipole, Da:	4.42
IP(EA), eV:	-10.3(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-amino-1-hydrazinyl-1-oxopropan-2-yl)oxy-2-methylbutan-2-yl] 5-(dithiolan-3-yl)pentanoate

Drug info:

PubChemData

Smile

CC(=O)NC1C([C@H](C(OC1OC)CO)O)O

DOS

IR

Vibrations