Geometry & MOs

Info

ID:	198890
PubChem CID:	79169001
Reduced:	ON3C16H27 (1)
Stoich.:	AB3C16D27 (1)
Weight, g/mol:	293.12949
ΔH_f, kcal/mol:	-41.2
Dipole, Da:	3.48
IP(EA), eV:	-8.81(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-3-[(2,5-diethylpyrazol-3-yl)methoxy]-6-methylpyridine

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)OCCN2CCCCC2)CC(C)N

DOS

IR

Vibrations