Geometry & MOs

Info

ID:	396954
PubChem CID:	135029505
Reduced:	NO2C17H17 (1)
Stoich.:	AB2C17D17 (1)
Weight, g/mol:	178.172151
ΔH_f, kcal/mol:	-17.4
Dipole, Da:	2.44
IP(EA), eV:	-8.81(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclobutyl-1-(1-methylcyclobutyl)cyclobutane

Drug info:

PubChemData

Smile

CN1[C@H]([C@@H](C1=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3

DOS

IR

Vibrations