Geometry & MOs

Info

ID:	255510
PubChem CID:	103132592
Reduced:	NC9H13 (2)
Stoich.:	AB9C13 (2)
Weight, g/mol:	221.189198
ΔH_f, kcal/mol:	10.52
Dipole, Da:	2.92
IP(EA), eV:	-8.76(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(1-methylpyrazol-3-yl)cyclopentyl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CC(C)(C)NCCC(C)(C)C1=CC=CC2=C1C=NC=C2

DOS

IR

Vibrations