Geometry & MOs

Info

ID:	330150
PubChem CID:	127247137
Reduced:	ON4C15H24 (1)
Stoich.:	AB4C15D24 (1)
Weight, g/mol:	280.168797
ΔH_f, kcal/mol:	-27.35
Dipole, Da:	4.08
IP(EA), eV:	-9.17(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]methyl]-1H-indole

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2CCN(C2)CC(=O)N3CCCCC3

DOS

IR

Vibrations