Geometry & MOs

Info

ID:	340180
PubChem CID:	127262189
Reduced:	N3O3C15H29 (1)
Stoich.:	A3B3C15D29 (1)
Weight, g/mol:	303.168188
ΔH_f, kcal/mol:	-177.27
Dipole, Da:	0.98
IP(EA), eV:	-9.11(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4S,5R)-5-hydroxy-2-methyl-4-(4-methyl-2,6,7-trioxabicyclo[2.2.2]octan-1-yl)hexan-2-yl] carbamate

Drug info:

PubChemData

Smile

CC(C)[C@@H](CC(C)(C)OC(=O)N)C(=O)N1CCCNCC1

DOS

IR

Vibrations