Geometry & MOs

Info

ID:	48066
PubChem CID:	10536909
Reduced:	OC7H10 (2)
Stoich.:	AB7C10 (2)
Weight, g/mol:	220.14633
ΔH_f, kcal/mol:	-73.69
Dipole, Da:	3.64
IP(EA), eV:	-9.51(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-ethenyl-3-(3-hydroxypropyl)phenyl]propan-1-ol

Drug info:

PubChemData

Smile

CC(C)(CCOCC1=CC=CC=C1)CC=O

DOS

IR

Vibrations