Geometry & MOs

Info

ID:	253334
PubChem CID:	103117796
Reduced:	ON4C13H14 (1)
Stoich.:	AB4C13D14 (1)
Weight, g/mol:	256.132411
ΔH_f, kcal/mol:	37.16
Dipole, Da:	8.51
IP(EA), eV:	-9.08(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanopropan-2-yl)-N,1-dimethylindazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=NN(C2=CC=CC=C21)C)C#N

DOS

IR

Vibrations