Geometry & MOs

Info

ID:	255655
PubChem CID:	103133813
Reduced:	ON2C11H16 (1)
Stoich.:	AB2C11D16 (1)
Weight, g/mol:	234.173213
ΔH_f, kcal/mol:	-12.7
Dipole, Da:	5.27
IP(EA), eV:	-9.72(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-methylpropyl)cyclopentyl]-(1-methylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CC1(CCCC1)C(=O)C2=NN(C=C2)C

DOS

IR

Vibrations