Geometry & MOs

Info

ID:	392921
PubChem CID:	135018466
Reduced:	NO4C19H27 (1)
Stoich.:	AB4C19D27 (1)
Weight, g/mol:	285.172879
ΔH_f, kcal/mol:	-110.0
Dipole, Da:	2.37
IP(EA), eV:	-9.11(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,7-dimethyl-1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]bicyclo[2.2.1]heptan-2-ol

Drug info:

PubChemData

Smile

CC/C=C(\C)/C[N@@+]1(C[C@@H]2C(OC(C1CC3=CC=CC=C3)O2)CO)[O-]

DOS

IR

Vibrations