Geometry & MOs

Info

ID:	259509
PubChem CID:	103167157
Reduced:	ON2C13H20 (1)
Stoich.:	AB2C13D20 (1)
Weight, g/mol:	249.172879
ΔH_f, kcal/mol:	1.9
Dipole, Da:	1.12
IP(EA), eV:	-9.21(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1-cyclobutyl-3-(4-methoxyphenyl)butan-2-ol

Drug info:

PubChemData

Smile

C1CC(C1)CC2=CN=C(O2)CCNC3CC3

DOS

IR

Vibrations