Geometry & MOs

Info

ID:	244535
PubChem CID:	99364333
Reduced:	ClO2F3N4H22C23 (1)
Stoich.:	AB2C3D4E22F23 (1)
Weight, g/mol:	397.109627
ΔH_f, kcal/mol:	-181.65
Dipole, Da:	6.12
IP(EA), eV:	-9.18(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methylsulfonyl-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]-2,3-dihydroindole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NC3=C(C=CC(=C3)C(=O)N(C)C(C)C)Cl

DOS

IR

Vibrations