Geometry & MOs

Info

ID:	423890
PubChem CID:	135120643
Reduced:	FN3O5C19H22 (1)
Stoich.:	AB3C5D19E22 (1)
Weight, g/mol:	380.101763
ΔH_f, kcal/mol:	-165.77
Dipole, Da:	1.69
IP(EA), eV:	-8.98(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-(3,4,5-trifluorophenyl)acetamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C2=C(C(=NO2)N3CCOC4(C3)CCNCC4)C(=O)O)F

DOS

IR

Vibrations