Geometry & MOs

Info

ID:	255912
PubChem CID:	103135585
Reduced:	NC5H7 (3)
Stoich.:	AB5C7 (3)
Weight, g/mol:	279.11384
ΔH_f, kcal/mol:	49.15
Dipole, Da:	1.96
IP(EA), eV:	-8.77(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CCC(C2=NN(C=C2)C)NC

DOS

IR

Vibrations