Geometry & MOs

Info

ID:	255324
PubChem CID:	103131378
Reduced:	ON3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	239.199762
ΔH_f, kcal/mol:	-28.13
Dipole, Da:	2.26
IP(EA), eV:	-8.65(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-N-ethyl-3-methyl-1-(1-methylpyrazol-3-yl)butan-1-amine

Drug info:

PubChemData

Smile

CCCC(C(C1=NN(C=C1)C)NCCC)OC

DOS

IR

Vibrations