Geometry & MOs

Info

ID:	196461
PubChem CID:	78834443
Reduced:	SF2N2O2C16H16 (1)
Stoich.:	AB2C2D2E16F16 (1)
Weight, g/mol:	426.121355
ΔH_f, kcal/mol:	-142.45
Dipole, Da:	2.69
IP(EA), eV:	-9.21(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-(phenylsulfanylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)C(=O)NC(C2=CC(=C(C=C2)F)F)C(=O)NC)C

DOS

IR

Vibrations