Geometry & MOs

Info

ID:	206690
PubChem CID:	80283970
Reduced:	NO2S2C13H21 (1)
Stoich.:	AB2C2D13E21 (1)
Weight, g/mol:	247.179696
ΔH_f, kcal/mol:	-87.0
Dipole, Da:	0.62
IP(EA), eV:	-8.91(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-(1H-imidazol-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine

Drug info:

PubChemData

Smile

CC(CSCC1=NC(=CS1)C(C)(C)C)C(=O)OC

DOS

IR

Vibrations