Geometry & MOs

Info

ID:	340512
PubChem CID:	127262523
Reduced:	ON4C15H16 (1)
Stoich.:	AB4C15D16 (1)
Weight, g/mol:	282.148061
ΔH_f, kcal/mol:	63.28
Dipole, Da:	4.55
IP(EA), eV:	-8.43(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-3-indol-2-ylidene-N-(2-methylpropyl)-1,2-dihydropyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)C\1=CNN/C1=C/2\C=C3C=CC=CC3=N2

DOS

IR

Vibrations