Geometry & MOs

Info

ID:	290401
PubChem CID:	104457719
Reduced:	SN2O3C14H22 (1)
Stoich.:	AB2C3D14E22 (1)
Weight, g/mol:	246.048129
ΔH_f, kcal/mol:	-119.99
Dipole, Da:	4.9
IP(EA), eV:	-8.44(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chlorothiophen-2-yl)-4-methoxycyclohexan-1-ol

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1S(=O)(=O)N)NC2CCC(CC2)OC

DOS

IR

Vibrations