Geometry & MOs

Info

ID:	355395
PubChem CID:	127288458
Reduced:	ON3C17H27 (1)
Stoich.:	AB3C17D27 (1)
Weight, g/mol:	275.199762
ΔH_f, kcal/mol:	-29.58
Dipole, Da:	4.98
IP(EA), eV:	-8.7(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentyl-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2CCCN2C(=O)C3CCCCC3

DOS

IR

Vibrations