Geometry & MOs

Info

ID:	403899
PubChem CID:	135062495
Reduced:	FN2O9C24H37 (1)
Stoich.:	AB2C9D24E37 (1)
Weight, g/mol:	256.182715
ΔH_f, kcal/mol:	-464.17
Dipole, Da:	7.38
IP(EA), eV:	-10.33(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-2-bicyclo[2.2.1]hept-5-enylidenemethoxy]adamantane

Drug info:

PubChemData

Smile

CC(C)[C@H]1C(OC(=O)N1C(=O)C2(CC2(C(=O)OC)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)F)(C)C

DOS

IR

Vibrations