Geometry & MOs

Info

ID:	216583
PubChem CID:	85086454
Reduced:	BrOC14H19 (1)
Stoich.:	ABC14D19 (1)
Weight, g/mol:	284.06794
ΔH_f, kcal/mol:	-28.08
Dipole, Da:	2.8
IP(EA), eV:	-9.33(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-2-(phenylselanylmethyl)cyclohexan-1-ol

Drug info:

PubChemData

Smile

CC(C)(C)C(C=CC1=CC=CC=C1Br)OC

DOS

IR

Vibrations