Geometry & MOs

Info

ID:	172290
PubChem CID:	75490345
Reduced:	SO2F3N3H10C16 (1)
Stoich.:	AB2C3D3E10F16 (1)
Weight, g/mol:	360.169859
ΔH_f, kcal/mol:	-124.88
Dipole, Da:	7.79
IP(EA), eV:	-8.91(-2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2-methyltetrazol-5-yl)phenyl]-1-propan-2-ylindole-3-carboxamide

Drug info:

PubChemData

Smile

C1C(C2=C3C(=NSN3)C=CC2=NC1=O)C4=CC=C(C=C4)OC(F)(F)F

DOS

IR

Vibrations