Geometry & MOs

Info

ID:	155406
PubChem CID:	56354983
Reduced:	SF2N2O5C19H22 (1)
Stoich.:	AB2C2D5E19F22 (1)
Weight, g/mol:	438.03906
ΔH_f, kcal/mol:	-276.23
Dipole, Da:	3.53
IP(EA), eV:	-8.75(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[2-[3-(difluoromethoxy)-4-methoxyphenyl]ethyl]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)NC1=CC=CC=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC(F)F

DOS

IR

Vibrations