Geometry & MOs

Info

ID:	410850
PubChem CID:	135083651
Reduced:	NOH13C15 (1)
Stoich.:	ABC13D15 (1)
Weight, g/mol:	189.115364
ΔH_f, kcal/mol:	29.54
Dipole, Da:	3.1
IP(EA), eV:	-9.6(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,5S)-6-(4-methoxyphenyl)-6-azabicyclo[3.1.0]hexane

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C=NC(=O)C2=CC=CC=C2

DOS

IR

Vibrations