Geometry & MOs

Info

ID:	130474
PubChem CID:	51090927
Reduced:	FNOC5H6 (3)
Stoich.:	ABCD5E6 (3)
Weight, g/mol:	326.135446
ΔH_f, kcal/mol:	-201.72
Dipole, Da:	7.09
IP(EA), eV:	-9.6(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]-1H-indazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2CCN(C2)CC(F)(F)F

DOS

IR

Vibrations