Geometry & MOs

Info

ID:	280934
PubChem CID:	103852003
Reduced:	ON2C14H18 (1)
Stoich.:	AB2C14D18 (1)
Weight, g/mol:	225.184112
ΔH_f, kcal/mol:	17.89
Dipole, Da:	4.07
IP(EA), eV:	-9.17(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(3,5-diethyl-1-methylpyrazol-4-yl)methylamino]propan-1-ol

Drug info:

PubChemData

Smile

CC(=C)COCCNCC1=CC=CC=C1C#N

DOS

IR

Vibrations