Geometry & MOs

Info

ID:	130818
PubChem CID:	51113928
Reduced:	N2O2C19H22 (1)
Stoich.:	A2B2C19D22 (1)
Weight, g/mol:	349.115045
ΔH_f, kcal/mol:	-34.46
Dipole, Da:	4.85
IP(EA), eV:	-9.29(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

C1CC(OC1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)C4CC4

DOS

IR

Vibrations