Geometry & MOs

Info

ID:	385540
PubChem CID:	134979356
Reduced:	CrOC9H14 (1)
Stoich.:	ABC9D14 (1)
Weight, g/mol:	282.09258
ΔH_f, kcal/mol:	15.02
Dipole, Da:	1.19
IP(EA), eV:	-7.29(1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4R)-4-(benzenesulfonyl)-3-methoxycyclohexen-1-yl]methanol

Drug info:

PubChemData

Smile

CC1=CCC(CC1)C(=[Cr])OC

DOS

IR

Vibrations