Geometry & MOs

Info

ID:	209526
PubChem CID:	80683380
Reduced:	ON5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	238.168128
ΔH_f, kcal/mol:	22.94
Dipole, Da:	4.22
IP(EA), eV:	-8.7(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-ethylpyrazol-4-yl)-1-(2-methyloxan-2-yl)ethanol

Drug info:

PubChemData

Smile

CN1C=NC(=N1)CCNC2CC(=O)N(C3=CC=CC=C23)C

DOS

IR

Vibrations