Geometry & MOs

Info

ID:	255936
PubChem CID:	103135738
Reduced:	NO3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	237.220498
ΔH_f, kcal/mol:	-160.59
Dipole, Da:	1.86
IP(EA), eV:	-8.93(1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-(1-methylpyrazol-3-yl)-2-propylpentan-1-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)COCC2CNCC(O2)(C)C

DOS

IR

Vibrations