Geometry & MOs

Info

ID:	361948
PubChem CID:	127304944
Reduced:	ON3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	359.06332
ΔH_f, kcal/mol:	28.31
Dipole, Da:	5.45
IP(EA), eV:	-9.0(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-5-cyclopropyl-N-(2,3-dihydro-1H-inden-1-ylmethyl)-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CC1C2=CC(=NN2)C(=O)NCC3CCC4=CC=CC=C34

DOS

IR

Vibrations