Geometry & MOs

Info

ID:	255318
PubChem CID:	103131332
Reduced:	ON3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	237.184112
ΔH_f, kcal/mol:	-22.66
Dipole, Da:	3.42
IP(EA), eV:	-8.97(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-(1-methylpyrazol-3-yl)-2-(oxan-2-yl)ethanamine

Drug info:

PubChemData

Smile

CNC(CC1CCCCO1)C2=NN(C=C2)C

DOS

IR

Vibrations