Geometry & MOs

Info

ID:	266008
PubChem CID:	103557566
Reduced:	SO2C12H18 (1)
Stoich.:	AB2C12D18 (1)
Weight, g/mol:	224.17763
ΔH_f, kcal/mol:	-77.51
Dipole, Da:	1.87
IP(EA), eV:	-8.89(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclohepten-1-yl)-2-(1-methoxycyclobutyl)ethanol

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(CC2(CCC2)OC)O

DOS

IR

Vibrations