Geometry & MOs

Info

ID:	198630
PubChem CID:	79127548
Reduced:	NO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	247.193614
ΔH_f, kcal/mol:	-77.9
Dipole, Da:	4.56
IP(EA), eV:	-9.33(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-aminobutan-2-yl)-2-phenylcyclohexan-1-ol

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C21)(C3(CCOCC3)CN)O

DOS

IR

Vibrations