Geometry & MOs

Info

ID:	390533
PubChem CID:	134999592
Reduced:	SiO2C19H32 (1)
Stoich.:	AB2C19D32 (1)
Weight, g/mol:	224.214016
ΔH_f, kcal/mol:	-147.37
Dipole, Da:	1.69
IP(EA), eV:	-8.79(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4E)-4-butyl-2,6,7-trimethylocta-4,6-dien-3-ol

Drug info:

PubChemData

Smile

CC(C)[C@H](/C(=C/CO[Si](C)(C)C(C)(C)C)/C1=CC=CC=C1)O

DOS

IR

Vibrations