Geometry & MOs

Info

ID:	255239
PubChem CID:	103130842
Reduced:	N3C16H21 (1)
Stoich.:	A3B16C21 (1)
Weight, g/mol:	269.189198
ΔH_f, kcal/mol:	53.34
Dipole, Da:	3.5
IP(EA), eV:	-8.65(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylpyrazol-3-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CNC(C1CCCC2=CC=CC=C12)C3=NN(C=C3)C

DOS

IR

Vibrations