Geometry & MOs

Info

ID:	71085
PubChem CID:	48414268
Reduced:	O2N3C13H21 (1)
Stoich.:	A2B3C13D21 (1)
Weight, g/mol:	357.140117
ΔH_f, kcal/mol:	-75.67
Dipole, Da:	4.2
IP(EA), eV:	-9.39(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-difluorophenyl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)COC2CCCCC2

DOS

IR

Vibrations