Geometry & MOs

Info

ID:	124916
PubChem CID:	50903229
Reduced:	N3O5C29H37 (1)
Stoich.:	A3B5C29D37 (1)
Weight, g/mol:	375.277344
ΔH_f, kcal/mol:	-163.69
Dipole, Da:	3.14
IP(EA), eV:	-8.56(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,5R,8S,9R)-6,8,9-trimethylspiro[3-oxabicyclo[3.3.1]non-6-ene-4,1'-cyclopentane]-1-yl]methyl N-cyclohexylcarbamate

Drug info:

PubChemData

Smile

C1CC[C@@H]([C@H](C1)CN2CCC(CC2)C3=NOC4=CC=CC=C43)CN5C(=O)C6C7CC(C6C5=O)C(C7O)O

DOS

IR

Vibrations