Geometry & MOs

Info

ID:	279833
PubChem CID:	103845293
Reduced:	N3C14H23 (1)
Stoich.:	A3B14C23 (1)
Weight, g/mol:	268.168797
ΔH_f, kcal/mol:	22.86
Dipole, Da:	4.05
IP(EA), eV:	-8.73(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopenten-1-yl)-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)CNCCC2=CCCC2

DOS

IR

Vibrations