Geometry & MOs

Info

ID:	309310
PubChem CID:	126544306
Reduced:	FN4O4C23H27 (1)
Stoich.:	AB4C4D23E27 (1)
Weight, g/mol:	480.107911
ΔH_f, kcal/mol:	-157.9
Dipole, Da:	2.55
IP(EA), eV:	-9.84(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-2-fluorophenyl]methyl]-1-methylsulfonyl-N-phenylazetidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(C1)C(=O)N(CC2=C(C=C(C=C2)C(=O)NN)F)C3=CC=CC=C3

DOS

IR

Vibrations