Geometry & MOs

Info

ID:	264352
PubChem CID:	103456665
Reduced:	N2O2C11H20 (1)
Stoich.:	A2B2C11D20 (1)
Weight, g/mol:	228.147393
ΔH_f, kcal/mol:	-94.03
Dipole, Da:	3.51
IP(EA), eV:	-9.04(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethyl-4-methoxypyrazol-3-yl)-3-methylbutane-1,2-diol

Drug info:

PubChemData

Smile

CC(C)C(C(CCC1=NC=CN1C)O)O

DOS

IR

Vibrations