Geometry & MOs

Info

ID:	254037
PubChem CID:	103122345
Reduced:	ClON3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	255.11384
ΔH_f, kcal/mol:	16.76
Dipole, Da:	6.31
IP(EA), eV:	-9.22(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloroethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)N(CCCl)CC2=CC=CC=C2

DOS

IR

Vibrations