Geometry & MOs

Info

ID:	374073
PubChem CID:	131323345
Reduced:	ON3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	215.142248
ΔH_f, kcal/mol:	-21.52
Dipole, Da:	4.1
IP(EA), eV:	-8.33(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethylpyrazol-3-yl)-1-phenylethanamine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)OC)C2(CCCCC2)N

DOS

IR

Vibrations