Geometry & MOs

Info

ID:	337073
PubChem CID:	127256638
Reduced:	O4C7H10 (1)
Stoich.:	A4B7C10 (1)
Weight, g/mol:	302.22458
ΔH_f, kcal/mol:	-163.87
Dipole, Da:	5.95
IP(EA), eV:	-9.65(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,5S)-2-phenyl-5-(4-propylcyclohexyl)oxan-2-ol

Drug info:

PubChemData

Smile

CC(=O)O.C1=CC(OC=C1)O

DOS

IR

Vibrations