Geometry & MOs

Info

ID:	285954
PubChem CID:	104141052
Reduced:	NO3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	221.141579
ΔH_f, kcal/mol:	-92.5
Dipole, Da:	2.18
IP(EA), eV:	-8.95(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-but-3-enoxy-6-propan-2-ylpyridin-4-yl)methanol

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)CO)OCC2=CC(=CC=C2)OC

DOS

IR

Vibrations