Geometry & MOs

Info

ID:	286634
PubChem CID:	104179569
Reduced:	NOC15H21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	265.123342
ΔH_f, kcal/mol:	-19.5
Dipole, Da:	2.02
IP(EA), eV:	-8.91(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[[3-(3-chlorophenyl)cyclobutyl]amino]methyl]cyclobutan-1-ol

Drug info:

PubChemData

Smile

C1CC(C1)(CNC2CC(C2)C3=CC=CC=C3)O

DOS

IR

Vibrations