Geometry & MOs

Info

ID:	57232
PubChem CID:	22395516
Reduced:	OC6H10 (3)
Stoich.:	AB6C10 (3)
Weight, g/mol:	220.182715
ΔH_f, kcal/mol:	-174.24
Dipole, Da:	3.28
IP(EA), eV:	-8.51(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5,5-trimethylhexyl)phenol

Drug info:

PubChemData

Smile

CC(C)CC1=C(C(=C(C(=C1CC(C)C)O)O)O)CC(C)C

DOS

IR

Vibrations