Geometry & MOs

Info

ID:	259642
PubChem CID:	103170037
Reduced:	OC6H11 (2)
Stoich.:	AB6C11 (2)
Weight, g/mol:	266.199428
ΔH_f, kcal/mol:	-95.53
Dipole, Da:	0.73
IP(EA), eV:	-9.7(2.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-ethoxycyclobutyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(CC2CC2)O

DOS

IR

Vibrations