Geometry & MOs

Info

ID:	155510
PubChem CID:	56365846
Reduced:	BrClNSF2O2H11C15 (1)
Stoich.:	ABCDE2F2G11H15 (1)
Weight, g/mol:	401.066399
ΔH_f, kcal/mol:	-142.15
Dipole, Da:	3.94
IP(EA), eV:	-9.21(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-chloro-2-(difluoromethylsulfanyl)phenyl]-3-(3,4-dimethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)Br)C(=O)NC2=C(C(=CC=C2)Cl)SC(F)F

DOS

IR

Vibrations