Geometry & MOs

Info

ID:	141230
PubChem CID:	52843540
Reduced:	N2O2F3C19H21 (1)
Stoich.:	A2B2C3D19E21 (1)
Weight, g/mol:	412.106848
ΔH_f, kcal/mol:	-195.99
Dipole, Da:	7.28
IP(EA), eV:	-9.45(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(methanesulfonamido)-4-methyl-N-[(1S,2S)-2-[2-(trifluoromethyl)phenyl]cyclopropyl]benzamide

Drug info:

PubChemData

Smile

C1CC1CN2C[C@@H](CC2=O)C(=O)N[C@@H]3C[C@@H]3C4=CC=CC=C4C(F)(F)F

DOS

IR

Vibrations